4728 lines
195 KiB
Plaintext
4728 lines
195 KiB
Plaintext
LAMMPS data file. msi2lmp v3.9.7 / 24 Oct 2015 / CGCMM for crambin-class1
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642 atoms
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652 bonds
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1181 angles
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1741 dihedrals
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123 impropers
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19 atom types
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39 bond types
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92 angle types
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154 dihedral types
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14 improper types
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-4.516462326 24.921899796 xlo xhi
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-1.933422685 22.266929626 ylo yhi
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-7.921999931 21.079420090 zlo zhi
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Masses
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1 14.006700 # n4
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2 1.007970 # hn
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3 12.011150 # ca
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4 1.007970 # h
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5 12.011150 # c'
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6 15.999400 # o'
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7 12.011150 # c1
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8 15.999400 # oh
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9 1.007970 # ho
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10 12.011150 # c3
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11 14.006700 # n
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12 12.011150 # c2
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13 32.064000 # s1
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14 12.011150 # cr
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15 14.006700 # n2
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16 12.011150 # cp
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17 12.011150 # cg
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18 12.011150 # c-
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19 15.999400 # o-
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Pair Coeffs # lj/cut/coul/long
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1 0.1669999743 3.5012320066 # n4
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2 0.0000000000 0.0000000000 # hn
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3 0.0389999952 3.8754094636 # ca
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4 0.0380000011 2.4499714540 # h
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5 0.1479999981 3.6170487995 # c'
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6 0.2280000124 2.8597848722 # o'
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7 0.0389999952 3.8754094636 # c1
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8 0.2280000124 2.8597848722 # oh
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9 0.0000000000 0.0000000000 # ho
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10 0.0389999952 3.8754094636 # c3
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11 0.1669999743 3.5012320066 # n
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12 0.0389999952 3.8754094636 # c2
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13 0.0429759086 3.3677544003 # s1
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14 0.1479999981 3.6170487995 # cr
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15 0.1669999743 3.5012320066 # n2
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16 0.1479999981 3.6170487995 # cp
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17 0.0389999952 3.8754094636 # cg
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18 0.1479999981 3.6170487995 # c-
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19 0.2280000124 2.8597848722 # o-
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Bond Coeffs # harmonic
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1 356.5988 1.4700 # n4-ca
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2 457.4592 1.0260 # n4-hn
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3 283.0924 1.5200 # ca-c'
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4 322.7158 1.5260 # ca-c1
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5 340.6175 1.1050 # ca-h
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6 615.3220 1.2300 # c'-o'
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7 388.0000 1.3200 # c'-n
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8 322.7158 1.5260 # c1-c3
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9 384.0000 1.4200 # c1-oh
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10 340.6175 1.1050 # h-c1
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11 540.6336 0.9600 # oh-ho
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12 340.6175 1.1050 # h-c3
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13 377.5752 1.4600 # ca-n
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14 483.4512 1.0260 # hn-n
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15 322.7158 1.5260 # ca-c2
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16 228.0000 1.8000 # c2-s1
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17 340.6175 1.1050 # h-c2
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18 180.0000 2.0000 # s1-s1
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19 377.5752 1.4600 # n-c2
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20 322.7158 1.5260 # c2-c2
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21 384.0000 1.4200 # oh-c2
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22 322.7158 1.5260 # c1-c2
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23 322.7158 1.5260 # c3-c2
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24 322.7158 1.5260 # ca-c3
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25 388.0000 1.3200 # n-cr
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26 388.0000 1.3200 # cr-n2
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27 457.4592 1.0260 # hn-n2
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28 283.0924 1.5200 # c'-c2
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29 388.0000 1.3200 # c'-n2
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30 283.0924 1.5100 # c2-cp
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31 480.0000 1.3400 # cp-cp
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32 363.4164 1.0800 # h-cp
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33 377.5752 1.4600 # n-cg
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34 283.0924 1.5200 # c'-cg
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35 340.6175 1.1050 # h-cg
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36 400.0000 1.3700 # c'-oh
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37 384.0000 1.3700 # oh-cp
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38 283.0924 1.5200 # ca-c-
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39 540.0000 1.2500 # c--o-
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Angle Coeffs # harmonic
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1 41.6000 110.0000 # hn-n4-ca
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2 36.0000 105.5000 # hn-n4-hn
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3 46.6000 110.5000 # c'-ca-c1
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4 50.0000 109.5000 # n4-ca-c'
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5 45.0000 109.5000 # h-ca-c'
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6 50.0000 109.5000 # n4-ca-c1
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7 44.4000 110.0000 # h-ca-c1
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8 57.3000 109.5000 # n4-ca-h
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9 68.0000 120.0000 # ca-c'-o'
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10 68.0000 120.0000 # o'-c'-n
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11 53.5000 114.1000 # ca-c'-n
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12 70.0000 109.5000 # oh-c1-c3
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13 46.6000 110.5000 # ca-c1-c3
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14 44.4000 110.0000 # h-c1-c3
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15 70.0000 109.5000 # ca-c1-oh
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16 57.0000 109.5000 # h-c1-oh
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17 44.4000 110.0000 # ca-c1-h
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18 58.5000 106.0000 # c1-oh-ho
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19 44.4000 110.0000 # h-c3-c1
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20 39.5000 106.4000 # h-c3-h
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21 111.0000 118.0000 # ca-n-c'
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22 35.0000 122.0000 # hn-n-ca
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23 37.5000 115.0000 # hn-n-c'
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24 50.0000 109.5000 # c'-ca-n
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25 50.0000 109.5000 # c1-ca-n
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26 51.5000 109.5000 # h-ca-n
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27 46.6000 110.5000 # c'-ca-c2
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28 50.0000 109.5000 # n-ca-c2
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29 44.4000 110.0000 # h-ca-c2
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30 62.0000 109.0000 # ca-c2-s1
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31 45.0000 109.0000 # h-c2-s1
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32 44.4000 110.0000 # ca-c2-h
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33 39.5000 106.4000 # h-c2-h
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34 75.0000 109.5000 # c2-s1-s1
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35 37.0000 120.0000 # ca-n-c2
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36 111.0000 118.0000 # c'-n-c2
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37 50.0000 109.5000 # n-c2-c2
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38 51.5000 109.5000 # h-c2-n
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39 44.4000 110.0000 # h-c2-c2
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40 46.6000 110.5000 # ca-c2-c2
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41 46.6000 110.5000 # c2-c2-c2
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42 70.0000 109.5000 # ca-c2-oh
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43 57.0000 109.5000 # h-c2-oh
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44 58.5000 106.0000 # ho-oh-c2
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45 46.6000 110.5000 # c3-c1-c2
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46 46.6000 110.5000 # ca-c1-c2
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47 44.4000 110.0000 # h-c1-c2
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48 46.6000 110.5000 # c1-c2-c3
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49 44.4000 110.0000 # h-c2-c3
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50 44.4000 110.0000 # h-c2-c1
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51 44.4000 110.0000 # h-c3-c2
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52 46.6000 110.5000 # c3-c1-c3
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53 46.6000 110.5000 # c'-ca-c3
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54 50.0000 109.5000 # c3-ca-n
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55 44.4000 110.0000 # h-ca-c3
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56 44.4000 110.0000 # ca-c3-h
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57 111.0000 118.0000 # c2-n-cr
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58 102.0000 120.0000 # n2-cr-n2
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59 102.0000 120.0000 # n-cr-n2
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60 37.5000 115.0000 # hn-n2-cr
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61 33.0000 125.0000 # hn-n2-hn
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62 46.6000 110.5000 # ca-c2-c'
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63 45.0000 109.5000 # h-c2-c'
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64 68.0000 120.0000 # o'-c'-n2
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65 68.0000 120.0000 # o'-c'-c2
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66 53.5000 114.1000 # c2-c'-n2
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67 37.5000 115.0000 # hn-n2-c'
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68 46.6000 110.5000 # ca-c2-cp
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69 44.4000 110.0000 # h-c2-cp
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70 90.0000 120.0000 # cp-cp-cp
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71 44.2000 120.0000 # c2-cp-cp
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72 37.0000 120.0000 # h-cp-cp
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73 46.6000 110.5000 # ca-c2-c1
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74 111.0000 118.0000 # c'-n-cg
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75 35.0000 122.0000 # hn-n-cg
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76 50.0000 109.5000 # c'-cg-n
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77 45.0000 109.5000 # h-cg-c'
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78 51.5000 109.5000 # h-cg-n
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79 39.5000 106.4000 # h-cg-h
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80 68.0000 120.0000 # o'-c'-cg
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81 53.5000 114.1000 # n-c'-cg
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82 46.6000 110.5000 # c'-c2-c2
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83 145.0000 123.0000 # o'-c'-oh
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84 122.8000 110.0000 # oh-c'-c2
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85 50.0000 112.0000 # c'-oh-ho
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86 60.0000 120.0000 # oh-cp-cp
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87 50.0000 109.0000 # ho-oh-cp
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88 46.6000 110.5000 # c2-ca-c-
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89 50.0000 109.5000 # n-ca-c-
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90 45.0000 109.5000 # h-ca-c-
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91 145.0000 123.0000 # o--c--o-
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92 68.0000 120.0000 # ca-c--o-
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Dihedral Coeffs # harmonic
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1 0.0889 1 3 # hn-n4-ca-c'
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2 0.0889 1 3 # hn-n4-ca-c1
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3 0.0889 1 3 # hn-n4-ca-h
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4 0.0000 1 0 # c1-ca-c'-o'
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5 0.0000 1 0 # c1-ca-c'-n
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6 0.0000 1 0 # n4-ca-c'-o'
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7 0.0000 1 0 # n4-ca-c'-n
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8 0.0000 1 0 # h-ca-c'-o'
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9 0.0000 1 0 # h-ca-c'-n
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10 0.1581 1 3 # c'-ca-c1-c3
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11 0.1581 1 3 # c'-ca-c1-oh
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12 0.1581 1 3 # c'-ca-c1-h
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13 0.1581 1 3 # n4-ca-c1-c3
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14 0.1581 1 3 # n4-ca-c1-oh
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15 0.1581 1 3 # n4-ca-c1-h
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16 0.1581 1 3 # h-ca-c1-c3
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17 0.1581 1 3 # h-ca-c1-oh
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18 0.1581 1 3 # h-ca-c1-h
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19 3.8000 -1 2 # o'-c'-n-ca
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20 1.8000 -1 2 # o'-c'-n-hn
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21 3.2000 -1 2 # ca-c'-n-ca
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22 1.2000 -1 2 # ca-c'-n-hn
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23 0.1581 1 3 # oh-c1-c3-h
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24 0.1581 1 3 # ca-c1-c3-h
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25 0.1581 1 3 # h-c1-c3-h
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26 0.1300 1 3 # c3-c1-oh-ho
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27 0.1300 1 3 # ca-c1-oh-ho
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28 0.1300 1 3 # h-c1-oh-ho
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29 0.0000 1 0 # c'-ca-n-c'
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30 0.0000 1 0 # c1-ca-n-c'
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31 0.0000 1 0 # h-ca-n-c'
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32 0.0000 1 0 # c'-ca-n-hn
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33 0.0000 1 0 # c1-ca-n-hn
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34 0.0000 1 0 # h-ca-n-hn
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35 0.0000 1 0 # n-ca-c'-o'
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36 0.0000 1 0 # n-ca-c'-n
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37 0.1581 1 3 # n-ca-c1-c3
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38 0.1581 1 3 # n-ca-c1-oh
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39 0.1581 1 3 # n-ca-c1-h
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40 0.0000 1 0 # c2-ca-n-c'
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41 0.0000 1 0 # c2-ca-n-hn
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42 0.0000 1 0 # c2-ca-c'-o'
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43 0.0000 1 0 # c2-ca-c'-n
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44 0.1581 1 3 # c'-ca-c2-s1
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45 0.1581 1 3 # c'-ca-c2-h
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46 0.1581 1 3 # n-ca-c2-s1
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47 0.1581 1 3 # n-ca-c2-h
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48 0.1581 1 3 # h-ca-c2-s1
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49 0.1581 1 3 # h-ca-c2-h
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50 0.1400 1 3 # ca-c2-s1-s1
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51 0.1400 1 3 # h-c2-s1-s1
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52 5.5000 1 2 # c2-s1-s1-c2
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53 3.8000 -1 2 # o'-c'-n-c2
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54 3.2000 -1 2 # ca-c'-n-c2
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55 0.0000 1 0 # c'-ca-n-c2
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56 0.0000 1 0 # c2-ca-n-c2
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57 0.0000 1 0 # h-ca-n-c2
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58 0.0000 1 0 # ca-n-c2-c2
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59 0.0000 1 0 # ca-n-c2-h
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60 0.0000 1 0 # c'-n-c2-c2
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61 0.0000 1 0 # c'-n-c2-h
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62 0.1581 1 3 # c'-ca-c2-c2
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63 0.1581 1 3 # n-ca-c2-c2
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64 0.1581 1 3 # h-ca-c2-c2
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65 0.1581 1 3 # n-c2-c2-c2
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66 0.1581 1 3 # h-c2-c2-n
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67 0.1581 1 3 # h-c2-c2-c2
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68 0.1581 1 3 # h-c2-c2-h
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69 0.1581 1 3 # ca-c2-c2-c2
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70 0.1581 1 3 # ca-c2-c2-h
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71 0.1581 1 3 # c'-ca-c2-oh
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72 0.1581 1 3 # n-ca-c2-oh
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73 0.1581 1 3 # h-ca-c2-oh
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74 0.1300 1 3 # ho-oh-c2-ca
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75 0.1300 1 3 # ho-oh-c2-h
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76 0.1581 1 3 # c'-ca-c1-c2
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77 0.1581 1 3 # n-ca-c1-c2
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78 0.1581 1 3 # h-ca-c1-c2
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79 0.1581 1 3 # c2-c1-c3-h
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80 0.1581 1 3 # c3-c1-c2-c3
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81 0.1581 1 3 # c3-c1-c2-h
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82 0.1581 1 3 # ca-c1-c2-c3
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83 0.1581 1 3 # ca-c1-c2-h
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84 0.1581 1 3 # h-c1-c2-c3
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85 0.1581 1 3 # h-c1-c2-h
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86 0.1581 1 3 # h-c3-c2-c1
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87 0.1581 1 3 # h-c3-c2-h
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88 0.1581 1 3 # c3-c1-c3-h
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89 0.0000 1 0 # c3-ca-n-c'
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90 0.0000 1 0 # c3-ca-n-hn
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91 0.0000 1 0 # c3-ca-c'-o'
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92 0.0000 1 0 # c3-ca-c'-n
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93 0.1581 1 3 # c'-ca-c3-h
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94 0.1581 1 3 # n-ca-c3-h
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95 0.1581 1 3 # h-ca-c3-h
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96 0.0000 1 0 # cr-n-c2-c2
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97 0.0000 1 0 # cr-n-c2-h
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98 3.4000 -1 2 # c2-n-cr-n2
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99 3.4000 -1 2 # n2-cr-n2-hn
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100 3.4000 -1 2 # n-cr-n2-hn
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101 0.1581 1 3 # c'-ca-c2-c'
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102 0.1581 1 3 # n-ca-c2-c'
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103 0.1581 1 3 # h-ca-c2-c'
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104 0.0000 1 0 # o'-c'-c2-ca
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105 0.0000 1 0 # n2-c'-c2-ca
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106 0.0000 1 0 # o'-c'-c2-h
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107 0.0000 1 0 # n2-c'-c2-h
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108 1.5000 -1 2 # o'-c'-n2-hn
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109 1.5000 -1 2 # c2-c'-n2-hn
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110 0.1581 1 3 # c'-ca-c2-cp
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111 0.1581 1 3 # n-ca-c2-cp
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112 0.1581 1 3 # h-ca-c2-cp
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113 0.0000 1 2 # ca-c2-cp-cp
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114 0.0000 1 2 # h-c2-cp-cp
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115 3.0000 -1 2 # cp-cp-cp-cp
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116 3.0000 -1 2 # h-cp-cp-cp
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117 3.0000 -1 2 # c2-cp-cp-cp
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118 3.0000 -1 2 # h-cp-cp-c2
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119 3.0000 -1 2 # h-cp-cp-h
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120 0.1581 1 3 # c'-ca-c2-c1
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121 0.1581 1 3 # n-ca-c2-c1
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122 0.1581 1 3 # h-ca-c2-c1
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123 0.1581 1 3 # c3-c1-c2-ca
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124 0.1581 1 3 # h-c1-c2-ca
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125 3.8000 -1 2 # o'-c'-n-cg
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126 3.2000 -1 2 # ca-c'-n-cg
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127 0.0000 1 0 # c'-n-cg-c'
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128 0.0000 1 0 # c'-n-cg-h
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129 0.0000 1 0 # hn-n-cg-c'
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130 0.0000 1 0 # hn-n-cg-h
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131 0.0000 1 0 # o'-c'-cg-n
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132 0.0000 1 0 # n-c'-cg-n
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133 0.0000 1 0 # o'-c'-cg-h
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134 0.0000 1 0 # n-c'-cg-h
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135 3.2000 -1 2 # cg-c'-n-ca
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136 1.2000 -1 2 # cg-c'-n-hn
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137 0.1581 1 3 # ca-c2-c2-c'
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138 0.1581 1 3 # h-c2-c2-c'
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139 0.0000 1 0 # o'-c'-c2-c2
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140 0.0000 1 0 # oh-c'-c2-c2
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141 0.0000 1 0 # oh-c'-c2-h
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142 2.2500 -1 2 # o'-c'-oh-ho
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143 2.2500 -1 2 # c2-c'-oh-ho
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144 3.0000 -1 2 # oh-cp-cp-cp
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145 3.0000 -1 2 # h-cp-cp-oh
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146 0.7500 -1 2 # ho-oh-cp-cp
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147 0.0000 1 0 # oh-c'-c2-ca
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148 0.0000 1 0 # c--ca-n-c'
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149 0.0000 1 0 # c--ca-n-hn
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150 0.0000 1 0 # c2-ca-c--o-
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151 0.0000 1 0 # n-ca-c--o-
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152 0.0000 1 0 # h-ca-c--o-
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153 0.1581 1 3 # c--ca-c2-c'
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154 0.1581 1 3 # c--ca-c2-h
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Improper Coeffs # cvff
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1 10.0000 -1 2 # ca-c'-n-o'
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2 0.0500 -1 2 # c'-n-ca-hn
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3 0.0500 -1 2 # c'-n-ca-c2
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4 10.0000 -1 2 # n-cr-n2-n2
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5 0.0500 -1 2 # hn-n2-cr-hn
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6 10.0000 -1 2 # c2-c'-n2-o'
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7 0.0500 -1 2 # hn-n2-c'-hn
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8 0.3700 -1 2 # c2-cp-cp-cp
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9 0.3700 -1 2 # h-cp-cp-cp
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10 0.0500 -1 2 # c'-n-cg-hn
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11 10.0000 -1 2 # cg-c'-n-o'
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12 11.6000 -1 2 # c2-c'-o'-oh
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13 0.0000 -1 2 # oh-cp-cp-cp
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14 11.6000 -1 2 # ca-c--o--o-
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Atoms # full
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|
1 1 1 -0.500000 17.047000885 14.098999977 3.625000000 0 0 0 # n4
|
|
2 1 2 0.360000 16.238992691 14.681707382 3.886676073 0 0 0 # hn
|
|
3 1 2 0.360000 17.917675018 14.581335068 3.889913321 0 0 0 # hn
|
|
4 1 2 0.360000 17.039421082 13.939416885 2.607465982 0 0 0 # hn
|
|
5 1 3 0.320000 16.966999054 12.784000397 4.337999821 0 0 0 # ca
|
|
6 1 4 0.100000 16.972635269 11.928232193 3.662923098 0 0 0 # h
|
|
7 1 5 0.380000 15.685000420 12.755000114 5.132999897 0 0 0 # c'
|
|
8 1 6 -0.380000 15.267999649 13.824999809 5.593999863 0 0 0 # o'
|
|
9 1 7 -0.070000 18.170000076 12.703000069 5.336999893 0 0 0 # c1
|
|
10 1 4 0.100000 18.120826721 13.621001244 5.922624588 0 0 0 # h
|
|
11 1 8 -0.380000 19.333999634 12.829000473 4.462999821 0 0 0 # oh
|
|
12 1 9 0.350000 19.691650391 13.794054985 4.503693104 0 0 0 # ho
|
|
13 1 10 -0.300000 18.149999619 11.545999527 6.303999901 0 0 0 # c3
|
|
14 1 4 0.100000 19.007284164 11.616475105 6.973474979 0 0 0 # h
|
|
15 1 4 0.100000 17.230155945 11.575787544 6.888035774 0 0 0 # h
|
|
16 1 4 0.100000 18.198083878 10.608263016 5.750428200 0 0 0 # h
|
|
17 2 11 -0.500000 15.114999771 11.555000305 5.264999866 0 0 0 # n
|
|
18 2 2 0.280000 15.528337479 10.717791557 4.830105782 0 0 0 # hn
|
|
19 2 3 0.120000 13.855999947 11.468999863 6.065999985 0 0 0 # ca
|
|
20 2 4 0.100000 13.508913994 12.491562843 6.214313030 0 0 0 # h
|
|
21 2 5 0.380000 14.163999557 10.784999847 7.379000187 0 0 0 # c'
|
|
22 2 6 -0.380000 14.993000031 9.862000465 7.442999840 0 0 0 # o'
|
|
23 2 7 -0.070000 12.732000351 10.711000443 5.261000156 0 0 0 # c1
|
|
24 2 4 0.100000 11.753349304 10.621357918 5.732493877 0 0 0 # h
|
|
25 2 8 -0.380000 13.307999611 9.439000130 4.926000118 0 0 0 # oh
|
|
26 2 9 0.350000 12.585855484 8.833214760 4.510751247 0 0 0 # ho
|
|
27 2 10 -0.300000 12.484000206 11.442000389 3.894999981 0 0 0 # c3
|
|
28 2 4 0.100000 11.803796768 10.849267006 3.283370495 0 0 0 # h
|
|
29 2 4 0.100000 12.044157028 12.421771049 4.081242085 0 0 0 # h
|
|
30 2 4 0.100000 13.431519508 11.563512802 3.370076180 0 0 0 # h
|
|
31 3 11 -0.500000 13.487999916 11.241000175 8.416999817 0 0 0 # n
|
|
32 3 2 0.280000 12.810626030 12.002311707 8.267102242 0 0 0 # hn
|
|
33 3 3 0.120000 13.659999847 10.706999779 9.786999702 0 0 0 # ca
|
|
34 3 4 0.100000 14.238283157 9.783084869 9.778588295 0 0 0 # h
|
|
35 3 5 0.380000 12.269000053 10.430999756 10.322999954 0 0 0 # c'
|
|
36 3 6 -0.380000 11.392999649 11.307999611 10.185000420 0 0 0 # o'
|
|
37 3 12 -0.300000 14.368000031 11.748000145 10.690999985 0 0 0 # c2
|
|
38 3 4 0.100000 13.670405388 12.570071220 10.851186752 0 0 0 # h
|
|
39 3 4 0.100000 14.606354713 11.254445076 11.633172989 0 0 0 # h
|
|
40 3 13 0.100000 15.885000229 12.425999641 10.015999794 0 0 0 # s1
|
|
41 4 11 -0.500000 12.019000053 9.272000313 10.928000450 0 0 0 # n
|
|
42 4 2 0.280000 12.770128250 8.579818726 11.060630798 0 0 0 # hn
|
|
43 4 3 0.120000 10.645999908 8.991000175 11.407999992 0 0 0 # ca
|
|
44 4 4 0.100000 10.045209885 9.855814934 11.126492500 0 0 0 # h
|
|
45 4 5 0.380000 10.654000282 8.793000221 12.918999672 0 0 0 # c'
|
|
46 4 6 -0.380000 11.659000397 8.295999527 13.491000175 0 0 0 # o'
|
|
47 4 12 -0.300000 10.057000160 7.751999855 10.682000160 0 0 0 # c2
|
|
48 4 4 0.100000 10.731808662 6.925758839 10.905740738 0 0 0 # h
|
|
49 4 4 0.100000 9.122684479 7.521792412 11.194015503 0 0 0 # h
|
|
50 4 13 0.100000 9.836999893 8.017999649 8.904000282 0 0 0 # s1
|
|
51 5 11 -0.420000 9.560999870 9.107999802 13.562999725 0 0 0 # n
|
|
52 5 3 0.060000 9.447999954 9.034000397 15.012000084 0 0 0 # ca
|
|
53 5 4 0.100000 10.341467857 9.534400940 15.385380745 0 0 0 # h
|
|
54 5 12 0.060000 8.366000175 9.803999901 12.958000183 0 0 0 # c2
|
|
55 5 4 0.100000 8.002507210 9.270477295 12.079748154 0 0 0 # h
|
|
56 5 4 0.100000 8.616027832 10.819077492 12.649448395 0 0 0 # h
|
|
57 5 5 0.380000 9.288000107 7.670000076 15.605999947 0 0 0 # c'
|
|
58 5 6 -0.380000 9.489999771 7.519000053 16.819000244 0 0 0 # o'
|
|
59 5 12 -0.200000 8.229999542 9.956999779 15.345000267 0 0 0 # c2
|
|
60 5 4 0.100000 7.714309216 9.644173622 16.252912521 0 0 0 # h
|
|
61 5 4 0.100000 8.527364731 10.997467041 15.475772858 0 0 0 # h
|
|
62 5 12 -0.200000 7.337999821 9.786000252 14.114000320 0 0 0 # c2
|
|
63 5 4 0.100000 6.782078266 8.848659515 14.135046959 0 0 0 # h
|
|
64 5 4 0.100000 6.614880562 10.595389366 14.013560295 0 0 0 # h
|
|
65 6 11 -0.500000 8.875000000 6.685999870 14.795999527 0 0 0 # n
|
|
66 6 2 0.280000 8.693690300 6.898229599 13.804543495 0 0 0 # hn
|
|
67 6 3 0.120000 8.673000336 5.314000130 15.279000282 0 0 0 # ca
|
|
68 6 4 0.100000 9.487320900 5.098019123 15.970617294 0 0 0 # h
|
|
69 6 5 0.380000 8.753000259 4.375999928 14.083000183 0 0 0 # c'
|
|
70 6 6 -0.380000 8.725999832 4.857999802 12.923000336 0 0 0 # o'
|
|
71 6 12 -0.170000 7.340000153 5.120999813 15.996000290 0 0 0 # c2
|
|
72 6 4 0.100000 7.303732872 4.135610104 16.460533142 0 0 0 # h
|
|
73 6 4 0.100000 7.204785347 5.896010399 16.750438690 0 0 0 # h
|
|
74 6 8 -0.380000 6.274000168 5.219999790 15.031000137 0 0 0 # oh
|
|
75 6 9 0.350000 6.086399078 6.211903572 14.826469421 0 0 0 # ho
|
|
76 7 11 -0.500000 8.880999565 3.075000048 14.357999802 0 0 0 # n
|
|
77 7 2 0.280000 8.958233833 2.761164188 15.335978508 0 0 0 # hn
|
|
78 7 3 0.120000 8.911999702 2.082999945 13.258000374 0 0 0 # ca
|
|
79 7 4 0.100000 9.752125740 2.304961205 12.599957466 0 0 0 # h
|
|
80 7 5 0.380000 7.580999851 2.089999914 12.505999565 0 0 0 # c'
|
|
81 7 6 -0.380000 7.670000076 2.030999899 11.244999886 0 0 0 # o'
|
|
82 7 7 -0.100000 9.206999779 0.676999986 13.923999786 0 0 0 # c1
|
|
83 7 4 0.100000 8.631069183 0.572530746 14.843504906 0 0 0 # h
|
|
84 7 12 -0.200000 10.713999748 0.702000022 14.312000275 0 0 0 # c2
|
|
85 7 4 0.100000 11.291265488 0.728613675 13.387794495 0 0 0 # h
|
|
86 7 4 0.100000 10.887344360 1.603095889 14.900283813 0 0 0 # h
|
|
87 7 10 -0.300000 8.810999870 -0.476999998 12.968999863 0 0 0 # c3
|
|
88 7 4 0.100000 9.032923698 -1.433422685 13.442394257 0 0 0 # h
|
|
89 7 4 0.100000 7.744652271 -0.418968171 12.750744820 0 0 0 # h
|
|
90 7 4 0.100000 9.376438141 -0.391609550 12.041049957 0 0 0 # h
|
|
91 7 10 -0.300000 11.185000420 -0.515999973 15.142000198 0 0 0 # c3
|
|
92 7 4 0.100000 11.020709038 -1.430322766 14.571805000 0 0 0 # h
|
|
93 7 4 0.100000 12.246717453 -0.414458960 15.366830826 0 0 0 # h
|
|
94 7 4 0.100000 10.619837761 -0.562440276 16.072879791 0 0 0 # h
|
|
95 8 11 -0.500000 6.458000183 2.161999941 13.159000397 0 0 0 # n
|
|
96 8 2 0.280000 6.476118088 2.187154531 14.188533783 0 0 0 # hn
|
|
97 8 3 0.120000 5.144999981 2.209000111 12.453000069 0 0 0 # ca
|
|
98 8 4 0.100000 5.026936531 1.265246391 11.920561790 0 0 0 # h
|
|
99 8 5 0.380000 5.114999771 3.378999949 11.461000443 0 0 0 # c'
|
|
100 8 6 -0.380000 4.664000034 3.267999887 10.343000412 0 0 0 # o'
|
|
101 8 7 -0.100000 3.994999886 2.354000092 13.477999687 0 0 0 # c1
|
|
102 8 4 0.100000 4.418568611 3.051678419 14.200449944 0 0 0 # h
|
|
103 8 10 -0.300000 2.716000080 2.891000032 12.869000435 0 0 0 # c3
|
|
104 8 4 0.100000 1.981043458 3.059607983 13.656088829 0 0 0 # h
|
|
105 8 4 0.100000 2.923026085 3.831490993 12.358395576 0 0 0 # h
|
|
106 8 4 0.100000 2.322393417 2.168816090 12.153719902 0 0 0 # h
|
|
107 8 10 -0.300000 3.757999897 1.031999946 14.208000183 0 0 0 # c3
|
|
108 8 4 0.100000 3.374393702 0.292122275 13.505486488 0 0 0 # h
|
|
109 8 4 0.100000 4.697329521 0.676970363 14.631930351 0 0 0 # h
|
|
110 8 4 0.100000 3.033046246 1.182916164 15.007855415 0 0 0 # h
|
|
111 9 11 -0.500000 5.605999947 4.546000004 11.940999985 0 0 0 # n
|
|
112 9 2 0.280000 5.984637260 4.591287613 12.897809029 0 0 0 # hn
|
|
113 9 3 0.120000 5.598000050 5.767000198 11.081999779 0 0 0 # ca
|
|
114 9 4 0.100000 4.565777779 5.921326160 10.767674446 0 0 0 # h
|
|
115 9 5 0.380000 6.440999985 5.526999950 9.850000381 0 0 0 # c'
|
|
116 9 6 -0.380000 6.052000046 5.933000088 8.744000435 0 0 0 # o'
|
|
117 9 10 -0.300000 6.021999836 6.977000237 11.890999794 0 0 0 # c3
|
|
118 9 4 0.100000 5.950239658 7.871601582 11.272420883 0 0 0 # h
|
|
119 9 4 0.100000 5.369528770 7.081964016 12.757813454 0 0 0 # h
|
|
120 9 4 0.100000 7.051515102 6.848640919 12.225253105 0 0 0 # h
|
|
121 10 11 -0.500000 7.646999836 4.908999920 10.005000114 0 0 0 # n
|
|
122 10 2 0.280000 7.968383789 4.648912430 10.948380470 0 0 0 # hn
|
|
123 10 3 0.120000 8.496000290 4.609000206 8.836999893 0 0 0 # ca
|
|
124 10 4 0.100000 8.672454834 5.551135063 8.318015099 0 0 0 # h
|
|
125 10 5 0.380000 7.797999859 3.608999968 7.875999928 0 0 0 # c'
|
|
126 10 6 -0.380000 7.877999783 3.778000116 6.651000023 0 0 0 # o'
|
|
127 10 12 -0.200000 9.847000122 4.019999981 9.305000305 0 0 0 # c2
|
|
128 10 4 0.110000 10.292553902 4.780714035 9.946011543 0 0 0 # h
|
|
129 10 4 0.110000 9.592742920 3.191395044 9.965959549 0 0 0 # h
|
|
130 10 12 -0.200000 10.751999855 3.607000113 8.149000168 0 0 0 # c2
|
|
131 10 4 0.130000 11.631093979 3.136696339 8.589575768 0 0 0 # h
|
|
132 10 4 0.130000 10.187005997 2.897431850 7.544521332 0 0 0 # h
|
|
133 10 12 -0.160000 11.225999832 4.698999882 7.243999958 0 0 0 # c2
|
|
134 10 4 0.130000 11.795847893 4.300052166 6.404825211 0 0 0 # h
|
|
135 10 4 0.130000 10.397437096 5.319350719 6.902313709 0 0 0 # h
|
|
136 10 11 -0.560000 12.142999649 5.571000099 8.034999847 0 0 0 # n
|
|
137 10 14 0.380000 12.758000374 6.609000206 7.442999840 0 0 0 # cr
|
|
138 10 15 -0.560000 12.538999557 6.932000160 6.157999992 0 0 0 # n2
|
|
139 10 2 0.280000 11.887275696 6.371951103 5.590105534 0 0 0 # hn
|
|
140 10 2 0.280000 13.022671700 7.739827156 5.740416050 0 0 0 # hn
|
|
141 10 15 -0.560000 13.600999832 7.322000027 8.201999664 0 0 0 # n2
|
|
142 10 2 0.280000 13.756224632 7.059009075 9.185687065 0 0 0 # hn
|
|
143 10 2 0.280000 14.093895912 8.133021355 7.801752567 0 0 0 # hn
|
|
144 11 11 -0.500000 7.185999870 2.582000017 8.444999695 0 0 0 # n
|
|
145 11 2 0.280000 7.181996822 2.472300768 9.469133377 0 0 0 # hn
|
|
146 11 3 0.120000 6.500000000 1.583999991 7.565000057 0 0 0 # ca
|
|
147 11 4 0.100000 7.232992172 1.158654571 6.879504681 0 0 0 # h
|
|
148 11 5 0.380000 5.381999969 2.312999964 6.772999763 0 0 0 # c'
|
|
149 11 6 -0.380000 5.212999821 2.016000032 5.557000160 0 0 0 # o'
|
|
150 11 12 -0.170000 5.907999992 0.462000012 8.399999619 0 0 0 # c2
|
|
151 11 4 0.100000 5.275885105 0.867496729 9.190001488 0 0 0 # h
|
|
152 11 4 0.100000 5.339412212 -0.222457558 7.770455360 0 0 0 # h
|
|
153 11 8 -0.380000 6.989999771 -0.272000015 9.012000084 0 0 0 # oh
|
|
154 11 9 0.350000 6.754035950 -0.477917194 9.993233681 0 0 0 # ho
|
|
155 12 11 -0.500000 4.647999763 3.181999922 7.446000099 0 0 0 # n
|
|
156 12 2 0.280000 4.830713749 3.344167471 8.446608543 0 0 0 # hn
|
|
157 12 3 0.120000 3.545000076 3.934999943 6.750999928 0 0 0 # ca
|
|
158 12 4 0.100000 2.931945086 3.139469147 6.327450275 0 0 0 # h
|
|
159 12 5 0.380000 4.106999874 4.850999832 5.690999985 0 0 0 # c'
|
|
160 12 6 -0.380000 3.536000013 5.000999928 4.617000103 0 0 0 # o'
|
|
161 12 12 -0.200000 2.663000107 4.677000046 7.748000145 0 0 0 # c2
|
|
162 12 4 0.100000 3.340831280 5.294844151 8.336993217 0 0 0 # h
|
|
163 12 4 0.100000 2.070847750 5.373784065 7.154748440 0 0 0 # h
|
|
164 12 5 0.380000 1.802000046 3.734999895 8.609999657 0 0 0 # c'
|
|
165 12 6 -0.380000 1.567000031 2.612999916 8.164999962 0 0 0 # o'
|
|
166 12 15 -0.560000 1.394000053 4.251999855 9.767000198 0 0 0 # n2
|
|
167 12 2 0.280000 1.661958218 5.212530613 10.024837494 0 0 0 # hn
|
|
168 12 2 0.280000 0.810311615 3.691485643 10.404206276 0 0 0 # hn
|
|
169 13 11 -0.500000 5.258999825 5.498000145 6.005000114 0 0 0 # n
|
|
170 13 2 0.280000 5.665558815 5.373039246 6.943080425 0 0 0 # hn
|
|
171 13 3 0.120000 5.928999901 6.357999802 5.054999828 0 0 0 # ca
|
|
172 13 4 0.100000 5.242126465 7.176824093 4.840915680 0 0 0 # h
|
|
173 13 5 0.380000 6.303999901 5.578000069 3.799000025 0 0 0 # c'
|
|
174 13 6 -0.380000 6.136000156 6.072000027 2.653000116 0 0 0 # o'
|
|
175 13 12 -0.200000 7.183000088 6.993999958 5.754000187 0 0 0 # c2
|
|
176 13 4 0.100000 6.822110653 7.422051907 6.689217091 0 0 0 # h
|
|
177 13 4 0.100000 7.827757359 6.160566807 6.032885551 0 0 0 # h
|
|
178 13 16 0.000000 7.883999825 8.005999565 4.882999897 0 0 0 # cp
|
|
179 13 16 -0.100000 8.906000137 7.585999966 4.026999950 0 0 0 # cp
|
|
180 13 4 0.100000 9.200509071 6.536970615 3.996972561 0 0 0 # h
|
|
181 13 16 -0.100000 7.532000065 9.373000145 4.982999802 0 0 0 # cp
|
|
182 13 4 0.100000 6.777885437 9.706417084 5.695912361 0 0 0 # h
|
|
183 13 16 -0.100000 9.560000420 8.538999557 3.194000006 0 0 0 # cp
|
|
184 13 4 0.100000 10.356478691 8.246096611 2.509945869 0 0 0 # h
|
|
185 13 16 -0.100000 8.175999641 10.281000137 4.144999981 0 0 0 # cp
|
|
186 13 4 0.100000 7.907211304 11.336964607 4.173122406 0 0 0 # h
|
|
187 13 16 -0.100000 9.140999794 9.845000267 3.292000055 0 0 0 # cp
|
|
188 13 4 0.100000 9.614526749 10.580624580 2.641823530 0 0 0 # h
|
|
189 14 11 -0.500000 6.900000095 4.389999866 3.989000082 0 0 0 # n
|
|
190 14 2 0.280000 7.056817055 4.026083469 4.939722538 0 0 0 # hn
|
|
191 14 3 0.120000 7.330999851 3.607000113 2.790999889 0 0 0 # ca
|
|
192 14 4 0.100000 8.025202751 4.266238213 2.269859314 0 0 0 # h
|
|
193 14 5 0.380000 6.116000175 3.210000038 1.914999962 0 0 0 # c'
|
|
194 14 6 -0.380000 6.239999771 3.144000053 0.684000015 0 0 0 # o'
|
|
195 14 12 -0.200000 8.145000458 2.404000044 3.240000010 0 0 0 # c2
|
|
196 14 4 0.100000 7.607684612 1.901341796 4.044192791 0 0 0 # h
|
|
197 14 4 0.100000 8.238607407 1.714848042 2.400710344 0 0 0 # h
|
|
198 14 5 0.380000 9.555000305 2.855999947 3.730000019 0 0 0 # c'
|
|
199 14 6 -0.380000 10.012999535 3.894999981 3.322999954 0 0 0 # o'
|
|
200 14 15 -0.560000 10.119999886 1.955999970 4.539000034 0 0 0 # n2
|
|
201 14 2 0.280000 9.602790833 1.105753064 4.804471970 0 0 0 # hn
|
|
202 14 2 0.280000 11.072957993 2.112127066 4.897321224 0 0 0 # hn
|
|
203 15 11 -0.500000 4.993000031 2.927000046 2.571000099 0 0 0 # n
|
|
204 15 2 0.280000 4.955123901 2.932416916 3.600289106 0 0 0 # hn
|
|
205 15 3 0.120000 3.782000065 2.598999977 1.741999984 0 0 0 # ca
|
|
206 15 4 0.100000 4.121348858 1.813766837 1.066462040 0 0 0 # h
|
|
207 15 5 0.380000 3.296000004 3.871000051 1.003999949 0 0 0 # c'
|
|
208 15 6 -0.380000 2.947000027 3.816999912 -0.188999996 0 0 0 # o'
|
|
209 15 7 -0.100000 2.697999954 1.952999949 2.608000040 0 0 0 # c1
|
|
210 15 4 0.100000 2.505213737 2.550559521 3.498986244 0 0 0 # h
|
|
211 15 10 -0.300000 1.383999944 1.825999975 1.805999994 0 0 0 # c3
|
|
212 15 4 0.100000 0.627347350 1.339950681 2.421900034 0 0 0 # h
|
|
213 15 4 0.100000 1.035640240 2.818121433 1.518877268 0 0 0 # h
|
|
214 15 4 0.100000 1.560454965 1.230180860 0.910475850 0 0 0 # h
|
|
215 15 10 -0.300000 3.174000025 0.532999992 3.005000114 0 0 0 # c3
|
|
216 15 4 0.100000 3.344338417 -0.058414809 2.105381727 0 0 0 # h
|
|
217 15 4 0.100000 4.101772785 0.605659664 3.572501659 0 0 0 # h
|
|
218 15 4 0.100000 2.411232710 0.051358268 3.616807222 0 0 0 # h
|
|
219 16 11 -0.500000 3.321000099 4.986999989 1.720000029 0 0 0 # n
|
|
220 16 2 0.280000 3.642014980 4.956790447 2.698231459 0 0 0 # hn
|
|
221 16 3 0.120000 2.890000105 6.284999847 1.126000047 0 0 0 # ca
|
|
222 16 4 0.100000 1.819724441 6.204565048 0.935894310 0 0 0 # h
|
|
223 16 5 0.380000 3.687000036 6.597000122 -0.111000001 0 0 0 # c'
|
|
224 16 6 -0.380000 3.200000048 7.146999836 -1.103000045 0 0 0 # o'
|
|
225 16 12 -0.300000 3.039000034 7.368999958 2.240000010 0 0 0 # c2
|
|
226 16 4 0.100000 2.427302361 7.046223164 3.082461596 0 0 0 # h
|
|
227 16 4 0.100000 4.076938152 7.344151497 2.571914196 0 0 0 # h
|
|
228 16 13 0.100000 2.559000015 9.013999939 1.649000049 0 0 0 # s1
|
|
229 17 11 -0.500000 4.997000217 6.227000237 -0.100000001 0 0 0 # n
|
|
230 17 2 0.280000 5.366806507 5.742030144 0.730028629 0 0 0 # hn
|
|
231 17 3 0.120000 5.894999981 6.488999844 -1.213000059 0 0 0 # ca
|
|
232 17 4 0.100000 5.606140137 7.505477905 -1.480268955 0 0 0 # h
|
|
233 17 5 0.380000 5.737999916 5.559999943 -2.408999920 0 0 0 # c'
|
|
234 17 6 -0.380000 6.228000164 5.901000023 -3.506999969 0 0 0 # o'
|
|
235 17 12 -0.200000 7.369999886 6.506999969 -0.731000006 0 0 0 # c2
|
|
236 17 4 0.110000 7.554117680 5.576966763 -0.193190947 0 0 0 # h
|
|
237 17 4 0.110000 8.006169319 6.572014809 -1.613701701 0 0 0 # h
|
|
238 17 12 -0.200000 7.717000008 7.686999798 0.206000000 0 0 0 # c2
|
|
239 17 4 0.130000 6.892404079 7.845237732 0.901055515 0 0 0 # h
|
|
240 17 4 0.130000 8.617112160 7.442208767 0.769892812 0 0 0 # h
|
|
241 17 12 -0.160000 7.948999882 8.946999550 -0.615000010 0 0 0 # c2
|
|
242 17 4 0.130000 7.120620728 9.063755989 -1.313753128 0 0 0 # h
|
|
243 17 4 0.130000 7.958537579 9.803778648 0.058749799 0 0 0 # h
|
|
244 17 11 -0.560000 9.211999893 8.855999947 -1.337000012 0 0 0 # n
|
|
245 17 14 0.380000 9.536999702 9.532999992 -2.430999994 0 0 0 # cr
|
|
246 17 15 -0.560000 8.659000397 10.350000381 -3.032000065 0 0 0 # n2
|
|
247 17 2 0.280000 7.687877178 10.401560783 -2.692646742 0 0 0 # hn
|
|
248 17 2 0.280000 8.956042290 10.925786018 -3.832710981 0 0 0 # hn
|
|
249 17 15 -0.560000 10.793000221 9.491000175 -2.898999929 0 0 0 # n2
|
|
250 17 2 0.280000 11.487204552 8.872345924 -2.456000090 0 0 0 # hn
|
|
251 17 2 0.280000 11.063426018 10.077307701 -3.701504469 0 0 0 # hn
|
|
252 18 11 -0.500000 5.051000118 4.410999775 -2.203999996 0 0 0 # n
|
|
253 18 2 0.280000 4.617259026 4.215945244 -1.290368676 0 0 0 # hn
|
|
254 18 3 0.120000 4.933000088 3.430999994 -3.325999975 0 0 0 # ca
|
|
255 18 4 0.100000 5.980045319 3.132587433 -3.378404140 0 0 0 # h
|
|
256 18 5 0.380000 4.396999836 4.013999939 -4.619999886 0 0 0 # c'
|
|
257 18 6 -0.380000 4.987999916 3.755000114 -5.686999798 0 0 0 # o'
|
|
258 18 12 -0.200000 4.196000099 2.184000015 -2.862999916 0 0 0 # c2
|
|
259 18 4 0.100000 3.339328766 2.530950308 -2.285211325 0 0 0 # h
|
|
260 18 4 0.100000 3.882649422 1.660040379 -3.765982628 0 0 0 # h
|
|
261 18 7 -0.100000 4.960000038 1.177999973 -1.991000056 0 0 0 # c1
|
|
262 18 4 0.100000 5.379372120 1.654240489 -1.104759574 0 0 0 # h
|
|
263 18 10 -0.300000 3.907000065 0.097000003 -1.633999944 0 0 0 # c3
|
|
264 18 4 0.100000 4.372385025 -0.676563323 -1.023166656 0 0 0 # h
|
|
265 18 4 0.100000 3.089181185 0.555318415 -1.077927470 0 0 0 # h
|
|
266 18 4 0.100000 3.518241882 -0.348654836 -2.549619913 0 0 0 # h
|
|
267 18 10 -0.300000 6.129000187 0.606000006 -2.767999887 0 0 0 # c3
|
|
268 18 4 0.100000 5.767732143 0.166402578 -3.697698832 0 0 0 # h
|
|
269 18 4 0.100000 6.839241505 1.401178122 -2.994605541 0 0 0 # h
|
|
270 18 4 0.100000 6.621874809 -0.161501810 -2.171245098 0 0 0 # h
|
|
271 19 11 -0.420000 3.328999996 4.795000076 -4.543000221 0 0 0 # n
|
|
272 19 3 0.060000 2.792000055 5.375999928 -5.796999931 0 0 0 # ca
|
|
273 19 4 0.100000 2.750592709 4.562232971 -6.520994663 0 0 0 # h
|
|
274 19 12 0.060000 2.421000004 4.940999985 -3.407999992 0 0 0 # c2
|
|
275 19 4 0.100000 2.893075705 5.502179623 -2.601574659 0 0 0 # h
|
|
276 19 4 0.100000 2.129873276 3.967023134 -3.014662504 0 0 0 # h
|
|
277 19 5 0.380000 3.572999954 6.539999962 -6.322000027 0 0 0 # c'
|
|
278 19 6 -0.380000 3.259999990 7.045000076 -7.421999931 0 0 0 # o'
|
|
279 19 12 -0.200000 1.358000040 5.765999794 -5.472000122 0 0 0 # c2
|
|
280 19 4 0.100000 1.137144327 6.795158386 -5.755116940 0 0 0 # h
|
|
281 19 4 0.100000 0.636163235 5.061525822 -5.885241508 0 0 0 # h
|
|
282 19 12 -0.200000 1.223000050 5.693999767 -3.993000031 0 0 0 # c2
|
|
283 19 4 0.100000 1.192069173 6.702612400 -3.580879211 0 0 0 # h
|
|
284 19 4 0.100000 0.303467065 5.167813301 -3.736705542 0 0 0 # h
|
|
285 20 11 -0.500000 4.565000057 7.046999931 -5.559000015 0 0 0 # n
|
|
286 20 2 0.280000 4.763685703 6.625352859 -4.640502453 0 0 0 # hn
|
|
287 20 17 0.020000 5.366000175 8.190999985 -6.018000126 0 0 0 # cg
|
|
288 20 4 0.100000 6.411324024 7.914688587 -5.879978657 0 0 0 # h
|
|
289 20 4 0.100000 5.204787731 8.272821426 -7.092902660 0 0 0 # h
|
|
290 20 5 0.380000 5.006999969 9.480999947 -5.280000210 0 0 0 # c'
|
|
291 20 6 -0.380000 5.534999847 10.510000229 -5.730000019 0 0 0 # o'
|
|
292 21 11 -0.500000 4.181000233 9.437999725 -4.262000084 0 0 0 # n
|
|
293 21 2 0.280000 3.805485964 8.521671295 -3.978747845 0 0 0 # hn
|
|
294 21 3 0.120000 3.766999960 10.609000206 -3.513000011 0 0 0 # ca
|
|
295 21 4 0.100000 3.186850548 11.287978172 -4.137912750 0 0 0 # h
|
|
296 21 5 0.380000 5.017000198 11.397000313 -3.042000055 0 0 0 # c'
|
|
297 21 6 -0.380000 5.947000027 10.756999969 -2.523000002 0 0 0 # o'
|
|
298 21 7 -0.070000 2.992000103 10.187999725 -2.224999905 0 0 0 # c1
|
|
299 21 4 0.100000 3.722551346 9.746408463 -1.547215223 0 0 0 # h
|
|
300 21 8 -0.380000 2.051000118 9.144000053 -2.622999907 0 0 0 # oh
|
|
301 21 9 0.350000 1.135602355 9.567562103 -2.831667185 0 0 0 # ho
|
|
302 21 10 -0.300000 2.259999990 11.348999977 -1.550999999 0 0 0 # c3
|
|
303 21 4 0.100000 1.741620898 10.986124992 -0.663473487 0 0 0 # h
|
|
304 21 4 0.100000 2.980043650 12.114913940 -1.262877345 0 0 0 # h
|
|
305 21 4 0.100000 1.535783529 11.774766922 -2.245502472 0 0 0 # h
|
|
306 22 11 -0.420000 4.971000195 12.703000069 -3.176000118 0 0 0 # n
|
|
307 22 3 0.060000 6.143000126 13.512999535 -2.696000099 0 0 0 # ca
|
|
308 22 4 0.100000 7.038496494 13.344851494 -3.294257641 0 0 0 # h
|
|
309 22 12 0.060000 3.963999987 13.567000389 -3.811000109 0 0 0 # c2
|
|
310 22 4 0.100000 3.145355940 13.595741272 -3.091906309 0 0 0 # h
|
|
311 22 4 0.100000 3.722736835 13.055393219 -4.742746353 0 0 0 # h
|
|
312 22 5 0.380000 6.400000095 13.232999802 -1.225000024 0 0 0 # c'
|
|
313 22 6 -0.380000 5.485000134 13.060999870 -0.381999999 0 0 0 # o'
|
|
314 22 12 -0.200000 5.703000069 14.968999863 -2.920000076 0 0 0 # c2
|
|
315 22 4 0.100000 5.180837631 15.406009674 -2.068842649 0 0 0 # h
|
|
316 22 4 0.100000 6.486554623 15.606681824 -3.329272270 0 0 0 # h
|
|
317 22 12 -0.200000 4.676000118 14.892999649 -3.996000051 0 0 0 # c2
|
|
318 22 4 0.100000 3.913127184 15.665482521 -3.899067879 0 0 0 # h
|
|
319 22 4 0.100000 5.117558002 14.866248131 -4.992198467 0 0 0 # h
|
|
320 23 11 -0.500000 7.728000164 13.296999931 -0.921000004 0 0 0 # n
|
|
321 23 2 0.280000 8.435604095 13.473001480 -1.648475647 0 0 0 # hn
|
|
322 23 3 0.120000 8.114000320 13.102999687 0.500000000 0 0 0 # ca
|
|
323 23 4 0.100000 7.816065788 12.094260216 0.785972416 0 0 0 # h
|
|
324 23 5 0.380000 7.427000046 14.072999954 1.409999967 0 0 0 # c'
|
|
325 23 6 -0.380000 7.035999775 13.682000160 2.539999962 0 0 0 # o'
|
|
326 23 12 -0.200000 9.647999763 13.284999847 0.660000026 0 0 0 # c2
|
|
327 23 4 0.100000 9.905550957 14.228507996 0.178793058 0 0 0 # h
|
|
328 23 4 0.100000 9.841214180 13.411215782 1.725287557 0 0 0 # h
|
|
329 23 12 -0.200000 10.439999580 12.093000412 0.063000001 0 0 0 # c2
|
|
330 23 4 0.100000 9.979146957 11.185737610 0.453625947 0 0 0 # h
|
|
331 23 4 0.100000 10.252198219 12.100539207 -1.010673165 0 0 0 # h
|
|
332 23 5 0.380000 11.940999985 12.170000076 0.391000003 0 0 0 # c'
|
|
333 23 6 -0.350000 12.416000366 13.225000381 0.680999994 0 0 0 # o'
|
|
334 23 8 -0.380000 12.538999557 11.069999695 0.291999996 0 0 0 # oh
|
|
335 23 9 0.350000 11.852339745 10.318097115 0.136945918 0 0 0 # ho
|
|
336 24 11 -0.500000 7.211999893 15.333999634 0.966000021 0 0 0 # n
|
|
337 24 2 0.280000 7.454528332 15.605654716 0.002525384 0 0 0 # hn
|
|
338 24 3 0.120000 6.613999844 16.316999435 1.912999988 0 0 0 # ca
|
|
339 24 4 0.100000 7.281579018 16.350204468 2.774008274 0 0 0 # h
|
|
340 24 5 0.380000 5.211999893 15.935999870 2.349999905 0 0 0 # c'
|
|
341 24 6 -0.380000 4.782000065 16.166000366 3.494999886 0 0 0 # o'
|
|
342 24 10 -0.300000 6.605000019 17.694999695 1.246000051 0 0 0 # c3
|
|
343 24 4 0.100000 6.237848759 18.439016342 1.952922821 0 0 0 # h
|
|
344 24 4 0.100000 7.617130280 17.956361771 0.937162876 0 0 0 # h
|
|
345 24 4 0.100000 5.953601360 17.672107697 0.372354269 0 0 0 # h
|
|
346 25 11 -0.500000 4.445000172 15.317999840 1.404999971 0 0 0 # n
|
|
347 25 2 0.280000 4.817237854 15.149471283 0.459517360 0 0 0 # hn
|
|
348 25 3 0.120000 3.073999882 14.894000053 1.756000042 0 0 0 # ca
|
|
349 25 4 0.100000 2.651019573 15.738821983 2.299565554 0 0 0 # h
|
|
350 25 5 0.380000 3.085000038 13.642999649 2.644999981 0 0 0 # c'
|
|
351 25 6 -0.380000 2.315000057 13.522999763 3.578000069 0 0 0 # o'
|
|
352 25 7 -0.100000 2.203999996 14.637000084 0.462000012 0 0 0 # c1
|
|
353 25 4 0.100000 2.766484499 14.064008713 -0.275151134 0 0 0 # h
|
|
354 25 12 -0.200000 1.815000057 16.048000336 -0.128999993 0 0 0 # c2
|
|
355 25 4 0.100000 2.730222702 16.635150909 -0.204643890 0 0 0 # h
|
|
356 25 4 0.100000 1.443681121 15.888158798 -1.141261339 0 0 0 # h
|
|
357 25 10 -0.300000 0.902999997 13.864000320 0.810999990 0 0 0 # c3
|
|
358 25 4 0.100000 0.304098606 13.734000206 -0.090398379 0 0 0 # h
|
|
359 25 4 0.100000 1.159095764 12.886850357 1.220502138 0 0 0 # h
|
|
360 25 4 0.100000 0.331401974 14.427850723 1.548189402 0 0 0 # h
|
|
361 25 10 -0.300000 0.755999982 16.760999680 0.757000029 0 0 0 # c3
|
|
362 25 4 0.100000 1.158126354 16.905153275 1.759802103 0 0 0 # h
|
|
363 25 4 0.100000 0.510290921 17.729721069 0.321907312 0 0 0 # h
|
|
364 25 4 0.100000 -0.144283146 16.148948669 0.811632454 0 0 0 # h
|
|
365 26 11 -0.500000 4.032000065 12.763999939 2.312999964 0 0 0 # n
|
|
366 26 2 0.280000 4.636651039 12.911288261 1.492266655 0 0 0 # hn
|
|
367 26 3 0.120000 4.179999828 11.548999786 3.187000036 0 0 0 # ca
|
|
368 26 4 0.100000 3.168948889 11.146821976 3.251257181 0 0 0 # h
|
|
369 26 5 0.380000 4.631999969 11.944000244 4.596000195 0 0 0 # c'
|
|
370 26 6 -0.380000 4.227000237 11.251999855 5.546999931 0 0 0 # o'
|
|
371 26 12 -0.300000 5.038000107 10.517999649 2.539000034 0 0 0 # c2
|
|
372 26 4 0.100000 5.986673355 10.992624283 2.288298368 0 0 0 # h
|
|
373 26 4 0.100000 5.186637402 9.715300560 3.261275530 0 0 0 # h
|
|
374 26 13 0.100000 4.348999977 9.793999672 1.021999955 0 0 0 # s1
|
|
375 27 11 -0.500000 5.407999992 13.012000084 4.693999767 0 0 0 # n
|
|
376 27 2 0.280000 5.691634178 13.513016701 3.839930773 0 0 0 # hn
|
|
377 27 3 0.120000 5.879000187 13.501999855 6.026000023 0 0 0 # ca
|
|
378 27 4 0.100000 6.445541859 12.670074463 6.444367886 0 0 0 # h
|
|
379 27 5 0.380000 4.696000099 13.907999992 6.881999969 0 0 0 # c'
|
|
380 27 6 -0.380000 4.527999878 13.421999931 8.024999619 0 0 0 # o'
|
|
381 27 10 -0.300000 6.880000114 14.614999771 5.829999924 0 0 0 # c3
|
|
382 27 4 0.100000 7.267490864 14.930619240 6.798676968 0 0 0 # h
|
|
383 27 4 0.100000 7.702079296 14.259757042 5.208639622 0 0 0 # h
|
|
384 27 4 0.100000 6.394177914 15.459349632 5.340969563 0 0 0 # h
|
|
385 28 11 -0.500000 3.826999903 14.802000046 6.357999802 0 0 0 # n
|
|
386 28 2 0.280000 3.955853701 15.176399231 5.407146454 0 0 0 # hn
|
|
387 28 3 0.120000 2.690999985 15.220999718 7.193999767 0 0 0 # ca
|
|
388 28 4 0.100000 3.191283464 15.484881401 8.125762939 0 0 0 # h
|
|
389 28 5 0.380000 1.672000051 14.131999969 7.434000015 0 0 0 # c'
|
|
390 28 6 -0.380000 0.947000027 14.112000465 8.468000412 0 0 0 # o'
|
|
391 28 7 -0.070000 1.985999942 16.520000458 6.613999844 0 0 0 # c1
|
|
392 28 4 0.100000 1.055821180 16.708566666 7.150013447 0 0 0 # h
|
|
393 28 8 -0.380000 1.664000034 16.221000671 5.230000019 0 0 0 # oh
|
|
394 28 9 0.350000 1.387834191 17.087430954 4.746335030 0 0 0 # ho
|
|
395 28 10 -0.300000 2.914000034 17.739000320 6.699999809 0 0 0 # c3
|
|
396 28 4 0.100000 2.420290470 18.604087830 6.257310867 0 0 0 # h
|
|
397 28 4 0.100000 3.144372940 17.947925568 7.744690895 0 0 0 # h
|
|
398 28 4 0.100000 3.837480545 17.532133102 6.159175873 0 0 0 # h
|
|
399 29 11 -0.500000 1.621000051 13.189999580 6.511000156 0 0 0 # n
|
|
400 29 2 0.280000 2.223951578 13.259345055 5.678810120 0 0 0 # hn
|
|
401 29 3 0.120000 0.714999974 12.045000076 6.657000065 0 0 0 # ca
|
|
402 29 4 0.100000 -0.294524491 12.413607597 6.838903904 0 0 0 # h
|
|
403 29 5 0.380000 1.125000000 11.125000000 7.815000057 0 0 0 # c'
|
|
404 29 6 -0.380000 0.286000013 10.631999969 8.545000076 0 0 0 # o'
|
|
405 29 12 -0.200000 0.754999995 11.229000092 5.322000027 0 0 0 # c2
|
|
406 29 4 0.100000 0.514248192 11.922528267 4.516296864 0 0 0 # h
|
|
407 29 4 0.100000 1.786919236 10.911371231 5.172484398 0 0 0 # h
|
|
408 29 16 0.000000 -0.202999994 10.043999672 5.354000092 0 0 0 # cp
|
|
409 29 16 -0.100000 -1.547000051 10.336999893 5.644999981 0 0 0 # cp
|
|
410 29 4 0.100000 -1.844175816 11.365451813 5.850120068 0 0 0 # h
|
|
411 29 16 -0.100000 0.193000004 8.750000000 5.099999905 0 0 0 # cp
|
|
412 29 4 0.100000 1.231727839 8.520407677 4.862445831 0 0 0 # h
|
|
413 29 16 -0.100000 -2.496000051 9.329000473 5.672999859 0 0 0 # cp
|
|
414 29 4 0.100000 -3.542724609 9.551148415 5.880649567 0 0 0 # h
|
|
415 29 16 -0.100000 -0.800999999 7.704999924 5.156000137 0 0 0 # cp
|
|
416 29 4 0.100000 -0.521442473 6.666428089 4.979036331 0 0 0 # h
|
|
417 29 16 0.030000 -2.078999996 8.031000137 5.429999828 0 0 0 # cp
|
|
418 29 8 -0.380000 -3.096999884 7.057000160 5.458000183 0 0 0 # oh
|
|
419 29 9 0.350000 -4.016462326 7.520978928 5.472573757 0 0 0 # ho
|
|
420 30 11 -0.500000 2.470000029 10.984000206 7.994999886 0 0 0 # n
|
|
421 30 2 0.280000 3.124760151 11.572608948 7.460463524 0 0 0 # hn
|
|
422 30 3 0.120000 2.986000061 9.994000435 8.949999809 0 0 0 # ca
|
|
423 30 4 0.100000 2.109365702 9.410336494 9.230978012 0 0 0 # h
|
|
424 30 5 0.380000 3.608999968 10.505000114 10.229999542 0 0 0 # c'
|
|
425 30 6 -0.380000 3.766000032 9.715000153 11.185999870 0 0 0 # o'
|
|
426 30 7 -0.070000 4.076000214 9.102999687 8.225000381 0 0 0 # c1
|
|
427 30 4 0.100000 4.516047001 8.447491646 8.976511002 0 0 0 # h
|
|
428 30 8 -0.380000 5.125000000 10.027000427 7.823999882 0 0 0 # oh
|
|
429 30 9 0.350000 5.989885330 9.809993744 8.339540482 0 0 0 # ho
|
|
430 30 10 -0.300000 3.493000031 8.324000359 7.034999847 0 0 0 # c3
|
|
431 30 4 0.100000 4.283595562 7.746788025 6.555538177 0 0 0 # h
|
|
432 30 4 0.100000 2.714145184 7.648486614 7.388787270 0 0 0 # h
|
|
433 30 4 0.100000 3.067262888 9.023551941 6.315641403 0 0 0 # h
|
|
434 31 11 -0.500000 3.983999968 11.763999939 10.241000175 0 0 0 # n
|
|
435 31 2 0.280000 3.725119591 12.370410919 9.449706078 0 0 0 # hn
|
|
436 31 17 0.020000 4.769000053 12.336000443 11.359999657 0 0 0 # cg
|
|
437 31 4 0.100000 4.444449425 13.369131088 11.484130859 0 0 0 # h
|
|
438 31 4 0.100000 4.479221344 11.798232079 12.262736320 0 0 0 # h
|
|
439 31 5 0.380000 6.255000114 12.243000031 11.105999947 0 0 0 # c'
|
|
440 31 6 -0.380000 7.037000179 12.750000000 11.954000473 0 0 0 # o'
|
|
441 32 11 -0.500000 6.710000038 11.630999565 9.991999626 0 0 0 # n
|
|
442 32 2 0.280000 6.054100990 11.116460800 9.387064934 0 0 0 # hn
|
|
443 32 3 0.120000 8.140000343 11.694000244 9.635000229 0 0 0 # ca
|
|
444 32 4 0.100000 8.678412437 11.410507202 10.539347649 0 0 0 # h
|
|
445 32 5 0.380000 8.500000000 13.140999794 9.206000328 0 0 0 # c'
|
|
446 32 6 -0.380000 7.580999851 13.949000359 8.944000244 0 0 0 # o'
|
|
447 32 12 -0.300000 8.503999710 10.685999870 8.529999733 0 0 0 # c2
|
|
448 32 4 0.100000 7.987734795 10.995699883 7.621343136 0 0 0 # h
|
|
449 32 4 0.100000 9.584586143 10.726516724 8.392916679 0 0 0 # h
|
|
450 32 13 0.100000 8.048000336 8.987000465 8.880999565 0 0 0 # s1
|
|
451 33 11 -0.500000 9.793000221 13.409999847 9.173000336 0 0 0 # n
|
|
452 33 2 0.280000 10.471553802 12.667460442 9.394585609 0 0 0 # hn
|
|
453 33 3 0.120000 10.279999733 14.760000229 8.822999954 0 0 0 # ca
|
|
454 33 4 0.100000 9.389740944 15.283022881 8.473735809 0 0 0 # h
|
|
455 33 5 0.380000 11.345999718 14.657999992 7.743000031 0 0 0 # c'
|
|
456 33 6 -0.380000 11.970999718 13.583000183 7.552000046 0 0 0 # o'
|
|
457 33 7 -0.100000 10.789999962 15.534999847 10.085000038 0 0 0 # c1
|
|
458 33 4 0.100000 11.123229027 16.501873016 9.707884789 0 0 0 # h
|
|
459 33 12 -0.200000 12.059000015 14.803000450 10.670999527 0 0 0 # c2
|
|
460 33 4 0.100000 11.743847847 13.842393875 11.078448296 0 0 0 # h
|
|
461 33 4 0.100000 12.756343842 14.617484093 9.854057312 0 0 0 # h
|
|
462 33 10 -0.300000 9.684000015 15.685999870 11.137999535 0 0 0 # c3
|
|
463 33 4 0.100000 10.058896065 16.270494461 11.978191376 0 0 0 # h
|
|
464 33 4 0.100000 8.827452660 16.194667816 10.695638657 0 0 0 # h
|
|
465 33 4 0.100000 9.378940582 14.700247765 11.489184380 0 0 0 # h
|
|
466 33 10 -0.300000 12.732999802 15.675999641 11.781000137 0 0 0 # c3
|
|
467 33 4 0.100000 12.021772385 15.850844383 12.588270187 0 0 0 # h
|
|
468 33 4 0.100000 13.606328964 15.155009270 12.173381805 0 0 0 # h
|
|
469 33 4 0.100000 13.041068077 16.631135941 11.355658531 0 0 0 # h
|
|
470 34 11 -0.500000 11.489999771 15.772999763 7.038000107 0 0 0 # n
|
|
471 34 2 0.280000 10.853153229 16.566915512 7.196191311 0 0 0 # hn
|
|
472 34 3 0.120000 12.552000046 15.876999855 6.035999775 0 0 0 # ca
|
|
473 34 4 0.100000 13.043725967 14.912866592 5.906565666 0 0 0 # h
|
|
474 34 5 0.380000 13.590000153 16.916999817 6.559999943 0 0 0 # c'
|
|
475 34 6 -0.380000 13.168000221 18.006000519 6.945000172 0 0 0 # o'
|
|
476 34 7 -0.100000 11.987000465 16.360000610 4.681000233 0 0 0 # c1
|
|
477 34 4 0.100000 11.502662659 17.321004868 4.854168892 0 0 0 # h
|
|
478 34 12 -0.200000 10.913999557 15.338000298 4.163000107 0 0 0 # c2
|
|
479 34 4 0.100000 11.380437851 14.426782608 3.788544178 0 0 0 # h
|
|
480 34 4 0.100000 10.170696259 15.118617058 4.929467201 0 0 0 # h
|
|
481 34 10 -0.300000 13.130999565 16.517000198 3.628999949 0 0 0 # c3
|
|
482 34 4 0.100000 12.714348793 16.881505966 2.690041304 0 0 0 # h
|
|
483 34 4 0.100000 13.869889259 17.228136063 3.998366594 0 0 0 # h
|
|
484 34 4 0.100000 13.608166695 15.551076889 3.463472128 0 0 0 # h
|
|
485 34 10 -0.300000 10.151000023 16.024000168 2.937999964 0 0 0 # c3
|
|
486 34 4 0.100000 10.865941048 16.258329391 2.149300337 0 0 0 # h
|
|
487 34 4 0.100000 9.395269394 15.340338707 2.551244020 0 0 0 # h
|
|
488 34 4 0.100000 9.670580864 16.941936493 3.276658058 0 0 0 # h
|
|
489 35 11 -0.500000 14.855999947 16.493000031 6.535999775 0 0 0 # n
|
|
490 35 2 0.280000 15.087069511 15.531770706 6.246958256 0 0 0 # hn
|
|
491 35 3 0.120000 15.930000305 17.454000473 6.940999985 0 0 0 # ca
|
|
492 35 4 0.100000 15.448633194 18.412040710 7.137327194 0 0 0 # h
|
|
493 35 5 0.380000 16.913000107 17.549999237 5.818999767 0 0 0 # c'
|
|
494 35 6 -0.380000 17.097000122 16.659999847 4.969999790 0 0 0 # o'
|
|
495 35 7 -0.100000 16.621999741 16.995000839 8.284999847 0 0 0 # c1
|
|
496 35 4 0.100000 17.372821808 17.751832962 8.512095451 0 0 0 # h
|
|
497 35 12 -0.200000 17.360000610 15.651000023 8.067000389 0 0 0 # c2
|
|
498 35 4 0.100000 16.597890854 14.882443428 7.938127518 0 0 0 # h
|
|
499 35 4 0.100000 17.962522507 15.757192612 7.164896488 0 0 0 # h
|
|
500 35 10 -0.300000 15.592000008 16.974000931 9.434000015 0 0 0 # c3
|
|
501 35 4 0.100000 16.095645905 16.731447220 10.369737625 0 0 0 # h
|
|
502 35 4 0.100000 15.121275902 17.953468323 9.518616676 0 0 0 # h
|
|
503 35 4 0.100000 14.830537796 16.222230911 9.226348877 0 0 0 # h
|
|
504 35 10 -0.300000 18.298000336 15.206000328 9.218999863 0 0 0 # c3
|
|
505 35 4 0.100000 17.719526291 15.091951370 10.135765076 0 0 0 # h
|
|
506 35 4 0.100000 18.762899399 14.254055977 8.962544441 0 0 0 # h
|
|
507 35 4 0.100000 19.071800232 15.958778381 9.369535446 0 0 0 # h
|
|
508 36 11 -0.420000 17.663999557 18.669000626 5.806000233 0 0 0 # n
|
|
509 36 3 0.060000 18.635000229 18.861000061 4.737999916 0 0 0 # ca
|
|
510 36 4 0.100000 18.191711426 18.625682831 3.770414352 0 0 0 # h
|
|
511 36 12 0.060000 17.371000290 19.899999619 6.596000195 0 0 0 # c2
|
|
512 36 4 0.100000 17.637220383 19.770334244 7.645006180 0 0 0 # h
|
|
513 36 4 0.100000 16.312007904 20.154773712 6.554459572 0 0 0 # h
|
|
514 36 5 0.380000 19.924999237 18.041999817 4.948999882 0 0 0 # c'
|
|
515 36 6 -0.380000 20.593000412 17.742000580 3.944999933 0 0 0 # o'
|
|
516 36 12 -0.200000 18.944999695 20.364000320 4.782999992 0 0 0 # c2
|
|
517 36 4 0.100000 20.011636734 20.533958435 4.929625034 0 0 0 # h
|
|
518 36 4 0.100000 18.596609116 20.857370377 3.875635624 0 0 0 # h
|
|
519 36 12 -0.200000 18.238000870 20.937000275 5.907999992 0 0 0 # c2
|
|
520 36 4 0.100000 18.980670929 21.346309662 6.592840672 0 0 0 # h
|
|
521 36 4 0.100000 17.637973785 21.766929626 5.534794807 0 0 0 # h
|
|
522 37 11 -0.500000 20.172000885 17.729999542 6.217000008 0 0 0 # n
|
|
523 37 2 0.280000 19.520402908 17.994186401 6.969678879 0 0 0 # hn
|
|
524 37 17 0.020000 21.451999664 16.968999863 6.513000011 0 0 0 # cg
|
|
525 37 4 0.100000 22.220170975 17.196077347 5.773777485 0 0 0 # h
|
|
526 37 4 0.100000 21.806970596 17.180898666 7.521560192 0 0 0 # h
|
|
527 37 5 0.380000 21.142999649 15.477999687 6.427000046 0 0 0 # c'
|
|
528 37 6 -0.380000 20.138000488 15.022999763 5.877999783 0 0 0 # o'
|
|
529 38 11 -0.500000 22.055000305 14.701000214 7.032000065 0 0 0 # n
|
|
530 38 2 0.280000 22.826601028 15.162067413 7.534940720 0 0 0 # hn
|
|
531 38 3 0.120000 22.018999100 13.241999626 7.019999981 0 0 0 # ca
|
|
532 38 4 0.100000 21.118928909 12.994981766 6.457010269 0 0 0 # h
|
|
533 38 5 0.380000 21.944000244 12.628000259 8.395999908 0 0 0 # c'
|
|
534 38 6 -0.380000 21.868999481 11.387000084 8.435000420 0 0 0 # o'
|
|
535 38 10 -0.300000 23.246000290 12.696999550 6.275000095 0 0 0 # c3
|
|
536 38 4 0.100000 23.164216995 11.613998413 6.182674408 0 0 0 # h
|
|
537 38 4 0.100000 23.296331406 13.143034935 5.281710148 0 0 0 # h
|
|
538 38 4 0.100000 24.149721146 12.946521759 6.830985546 0 0 0 # h
|
|
539 39 11 -0.500000 21.893999100 13.435000420 9.435999870 0 0 0 # n
|
|
540 39 2 0.280000 21.824220657 14.451409340 9.284524918 0 0 0 # hn
|
|
541 39 3 0.120000 21.936000824 12.911000252 10.809000015 0 0 0 # ca
|
|
542 39 4 0.100000 22.114582062 11.836632729 10.764920235 0 0 0 # h
|
|
543 39 5 0.380000 20.614999771 13.190999985 11.520999908 0 0 0 # c'
|
|
544 39 6 -0.380000 20.357000351 14.317000389 11.947999954 0 0 0 # o'
|
|
545 39 7 -0.070000 23.131000519 13.600999832 11.593000412 0 0 0 # c1
|
|
546 39 4 0.100000 22.981323242 14.676721573 11.685302734 0 0 0 # h
|
|
547 39 8 -0.380000 24.284000397 13.401000023 10.708999634 0 0 0 # oh
|
|
548 39 9 0.350000 24.421899796 14.240586281 10.128500938 0 0 0 # ho
|
|
549 39 10 -0.300000 23.340000153 12.935000420 12.961999893 0 0 0 # c3
|
|
550 39 4 0.100000 24.219049454 13.362584114 13.444229126 0 0 0 # h
|
|
551 39 4 0.100000 22.463815689 13.106077194 13.587406158 0 0 0 # h
|
|
552 39 4 0.100000 23.485591888 11.863260269 12.826802254 0 0 0 # h
|
|
553 40 11 -0.500000 19.826999664 12.109999657 11.642000198 0 0 0 # n
|
|
554 40 2 0.280000 20.122940063 11.185415268 11.297814369 0 0 0 # hn
|
|
555 40 3 0.120000 18.503999710 12.312000275 12.298000336 0 0 0 # ca
|
|
556 40 4 0.100000 18.057098389 13.220839500 11.895023346 0 0 0 # h
|
|
557 40 5 0.380000 18.684000015 12.451000214 13.784000397 0 0 0 # c'
|
|
558 40 6 -0.380000 19.533000946 11.718000412 14.362000465 0 0 0 # o'
|
|
559 40 12 -0.300000 17.582000732 11.116999626 11.996000290 0 0 0 # c2
|
|
560 40 4 0.100000 18.086227417 10.251184464 12.425209045 0 0 0 # h
|
|
561 40 4 0.100000 16.700305939 11.271791458 12.617895126 0 0 0 # h
|
|
562 40 13 0.100000 17.198999405 10.928999901 10.237000465 0 0 0 # s1
|
|
563 41 11 -0.420000 17.879999161 13.265999794 14.425999641 0 0 0 # n
|
|
564 41 3 0.060000 17.923999786 13.420999527 15.876999855 0 0 0 # ca
|
|
565 41 4 0.100000 18.941534042 13.662834167 16.183986664 0 0 0 # h
|
|
566 41 12 0.060000 16.858999252 14.149999619 13.779000282 0 0 0 # c2
|
|
567 41 4 0.100000 16.215919495 13.587250710 13.102345467 0 0 0 # h
|
|
568 41 4 0.100000 17.329374313 14.943244934 13.197958946 0 0 0 # h
|
|
569 41 5 0.380000 17.392000198 12.206000328 16.593999863 0 0 0 # c'
|
|
570 41 6 -0.380000 16.652000427 11.368000031 16.033000946 0 0 0 # o'
|
|
571 41 12 -0.200000 17.076000214 14.657999992 16.145000458 0 0 0 # c2
|
|
572 41 4 0.100000 16.444255829 14.584781647 17.030233383 0 0 0 # h
|
|
573 41 4 0.100000 17.617696762 15.599854469 16.057970047 0 0 0 # h
|
|
574 41 12 -0.200000 16.097999573 14.689000130 14.996999741 0 0 0 # c2
|
|
575 41 4 0.100000 15.253420830 14.016077042 15.145191193 0 0 0 # h
|
|
576 41 4 0.100000 15.789084435 15.700772285 14.734343529 0 0 0 # h
|
|
577 42 11 -0.500000 17.728000641 12.123999596 17.884000778 0 0 0 # n
|
|
578 42 2 0.280000 18.268247604 12.885299683 18.319267273 0 0 0 # hn
|
|
579 42 17 0.020000 17.333999634 10.956000328 18.690999985 0 0 0 # cg
|
|
580 42 4 0.100000 17.766984940 10.084270477 18.200376511 0 0 0 # h
|
|
581 42 4 0.100000 17.761390686 11.109748840 19.681858063 0 0 0 # h
|
|
582 42 5 0.380000 15.875000000 10.687999725 18.871000290 0 0 0 # c'
|
|
583 42 6 -0.380000 15.434000015 9.550000191 19.166000366 0 0 0 # o'
|
|
584 43 11 -0.500000 15.036000252 11.746999741 18.715000153 0 0 0 # n
|
|
585 43 2 0.280000 15.424054146 12.679033279 18.510971069 0 0 0 # hn
|
|
586 43 3 0.120000 13.564000130 11.572999954 18.836000443 0 0 0 # ca
|
|
587 43 4 0.100000 13.474464417 10.696401596 19.477605820 0 0 0 # h
|
|
588 43 5 0.380000 12.935999870 11.227000237 17.469999313 0 0 0 # c'
|
|
589 43 6 -0.380000 11.720000267 11.039999962 17.427999496 0 0 0 # o'
|
|
590 43 12 -0.200000 12.932999611 12.737000465 19.579999924 0 0 0 # c2
|
|
591 43 4 0.100000 11.860553741 12.547567368 19.625556946 0 0 0 # h
|
|
592 43 4 0.100000 13.367670059 12.754883766 20.579420090 0 0 0 # h
|
|
593 43 5 0.380000 13.140000343 14.093999863 18.958000183 0 0 0 # c'
|
|
594 43 6 -0.350000 14.109000206 14.303000450 18.211999893 0 0 0 # o'
|
|
595 43 8 -0.380000 12.267000198 14.963000298 19.264999390 0 0 0 # oh
|
|
596 43 9 0.350000 12.695192337 15.899699211 19.252908707 0 0 0 # ho
|
|
597 44 11 -0.500000 13.725000381 11.173999786 16.424999237 0 0 0 # n
|
|
598 44 2 0.280000 14.713005066 11.441411018 16.540052414 0 0 0 # hn
|
|
599 44 3 0.120000 13.256999969 10.744999886 15.081000328 0 0 0 # ca
|
|
600 44 4 0.100000 12.264418602 10.301728249 15.160951614 0 0 0 # h
|
|
601 44 5 0.380000 14.274999619 9.687000275 14.612000465 0 0 0 # c'
|
|
602 44 6 -0.380000 14.930000305 9.862000465 13.567999840 0 0 0 # o'
|
|
603 44 12 -0.200000 13.199999809 11.913999557 14.071000099 0 0 0 # c2
|
|
604 44 4 0.100000 14.121270180 12.493051529 14.134719849 0 0 0 # h
|
|
605 44 4 0.100000 13.091276169 11.516075134 13.062071800 0 0 0 # h
|
|
606 44 16 0.000000 12.000000000 12.819000244 14.399000168 0 0 0 # cp
|
|
607 44 16 -0.100000 12.119000435 13.852999687 15.331999779 0 0 0 # cp
|
|
608 44 4 0.100000 13.067806244 14.011770248 15.844503403 0 0 0 # h
|
|
609 44 16 -0.100000 10.774999619 12.616999626 13.762000084 0 0 0 # cp
|
|
610 44 4 0.100000 10.673528671 11.813380241 13.032616615 0 0 0 # h
|
|
611 44 16 -0.100000 11.045000076 14.675000191 15.609999657 0 0 0 # cp
|
|
612 44 4 0.100000 11.163392067 15.500525475 16.311847687 0 0 0 # h
|
|
613 44 16 -0.100000 9.675999641 13.432999611 14.048000336 0 0 0 # cp
|
|
614 44 4 0.100000 8.726944923 13.273748398 13.536108017 0 0 0 # h
|
|
615 44 16 0.030000 9.802000046 14.456000328 14.996000290 0 0 0 # cp
|
|
616 44 8 -0.380000 8.739999771 15.265000343 15.269000053 0 0 0 # oh
|
|
617 44 9 0.350000 9.048466682 16.247716904 15.272980690 0 0 0 # ho
|
|
618 45 11 -0.500000 14.342000008 8.640000343 15.421999931 0 0 0 # n
|
|
619 45 2 0.280000 13.638368607 8.505084991 16.162000656 0 0 0 # hn
|
|
620 45 3 0.120000 15.444999695 7.666999817 15.246000290 0 0 0 # ca
|
|
621 45 4 0.100000 16.332574844 8.216528893 14.932426453 0 0 0 # h
|
|
622 45 5 0.380000 15.170999527 6.532999992 14.279999733 0 0 0 # c'
|
|
623 45 6 -0.380000 16.093000412 5.704999924 14.038999557 0 0 0 # o'
|
|
624 45 10 -0.300000 15.680000305 7.098999977 16.681999207 0 0 0 # c3
|
|
625 45 4 0.100000 16.535034180 6.423069000 16.670495987 0 0 0 # h
|
|
626 45 4 0.100000 15.876356125 7.920741558 17.370683670 0 0 0 # h
|
|
627 45 4 0.100000 14.792826653 6.556271553 17.008296967 0 0 0 # h
|
|
628 46 11 -0.500000 13.965999603 6.501999855 13.739000320 0 0 0 # n
|
|
629 46 2 0.280000 13.318986893 7.281283855 13.926057816 0 0 0 # hn
|
|
630 46 3 0.120000 13.512000084 5.394999981 12.878000259 0 0 0 # ca
|
|
631 46 4 0.100000 14.292015076 4.641647816 12.988171577 0 0 0 # h
|
|
632 46 18 0.140000 13.310999870 5.853000164 11.454999924 0 0 0 # c-
|
|
633 46 19 -0.570000 13.732999802 6.928999901 11.026000023 0 0 0 # o-
|
|
634 46 19 -0.570000 12.703000069 4.973000050 10.746000290 0 0 0 # o-
|
|
635 46 12 -0.200000 12.265999794 4.769000053 13.501000404 0 0 0 # c2
|
|
636 46 4 0.100000 11.471806526 5.515164375 13.476576805 0 0 0 # h
|
|
637 46 4 0.100000 11.959742546 3.937092304 12.866779327 0 0 0 # h
|
|
638 46 5 0.380000 12.538000107 4.303999901 14.921999931 0 0 0 # c'
|
|
639 46 6 -0.380000 11.982000351 4.848999977 15.885999680 0 0 0 # o'
|
|
640 46 15 -0.560000 13.406999588 3.298000097 15.015000343 0 0 0 # n2
|
|
641 46 2 0.280000 13.826193810 2.899175167 14.162875175 0 0 0 # hn
|
|
642 46 2 0.280000 13.659525871 2.919377804 15.938999176 0 0 0 # hn
|
|
|
|
Bonds
|
|
|
|
1 1 1 5
|
|
2 2 1 3
|
|
3 2 1 4
|
|
4 2 1 2
|
|
5 3 5 7
|
|
6 4 5 9
|
|
7 5 5 6
|
|
8 6 7 8
|
|
9 7 7 17
|
|
10 8 9 13
|
|
11 9 9 11
|
|
12 10 10 9
|
|
13 11 11 12
|
|
14 12 14 13
|
|
15 12 15 13
|
|
16 12 16 13
|
|
17 13 19 17
|
|
18 14 18 17
|
|
19 3 19 21
|
|
20 4 19 23
|
|
21 5 19 20
|
|
22 6 21 22
|
|
23 7 21 31
|
|
24 8 23 27
|
|
25 9 23 25
|
|
26 10 24 23
|
|
27 11 25 26
|
|
28 12 28 27
|
|
29 12 29 27
|
|
30 12 30 27
|
|
31 13 33 31
|
|
32 14 32 31
|
|
33 3 33 35
|
|
34 15 33 37
|
|
35 5 33 34
|
|
36 6 35 36
|
|
37 7 35 41
|
|
38 16 37 40
|
|
39 17 38 37
|
|
40 17 39 37
|
|
41 18 40 562
|
|
42 13 43 41
|
|
43 14 42 41
|
|
44 3 43 45
|
|
45 15 43 47
|
|
46 5 43 44
|
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47 6 45 46
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48 7 45 51
|
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49 16 47 50
|
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50 17 48 47
|
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51 17 49 47
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52 18 50 450
|
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53 13 52 51
|
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54 19 51 54
|
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55 3 52 57
|
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56 15 52 59
|
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57 5 52 53
|
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58 20 54 62
|
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59 17 55 54
|
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60 17 56 54
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61 6 57 58
|
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62 7 57 65
|
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63 20 59 62
|
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64 17 60 59
|
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65 17 61 59
|
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66 17 63 62
|
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67 17 64 62
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68 13 67 65
|
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69 14 66 65
|
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70 3 67 69
|
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71 15 67 71
|
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72 5 67 68
|
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73 6 69 70
|
|
74 7 69 76
|
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75 21 74 71
|
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76 17 72 71
|
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77 17 73 71
|
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78 11 74 75
|
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79 13 78 76
|
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80 14 77 76
|
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81 3 78 80
|
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82 4 78 82
|
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83 5 78 79
|
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84 6 80 81
|
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85 7 80 95
|
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86 8 82 87
|
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87 22 82 84
|
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88 10 83 82
|
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89 23 91 84
|
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90 17 85 84
|
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91 17 86 84
|
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92 12 88 87
|
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93 12 89 87
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94 12 90 87
|
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95 12 92 91
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96 12 93 91
|
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97 12 94 91
|
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98 13 97 95
|
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99 14 96 95
|
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100 3 97 99
|
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101 4 97 101
|
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102 5 97 98
|
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103 6 99 100
|
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104 7 99 111
|
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105 8 101 103
|
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106 8 101 107
|
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107 10 102 101
|
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108 12 104 103
|
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109 12 105 103
|
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110 12 106 103
|
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111 12 108 107
|
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112 12 109 107
|
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113 12 110 107
|
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114 13 113 111
|
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115 14 112 111
|
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116 3 113 115
|
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117 24 113 117
|
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118 5 113 114
|
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119 6 115 116
|
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120 7 115 121
|
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121 12 118 117
|
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122 12 119 117
|
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123 12 120 117
|
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124 13 123 121
|
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125 14 122 121
|
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126 3 123 125
|
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127 15 123 127
|
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128 5 123 124
|
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129 6 125 126
|
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130 7 125 144
|
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131 20 127 130
|
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132 17 128 127
|
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133 17 129 127
|
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134 20 130 133
|
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135 17 131 130
|
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136 17 132 130
|
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137 19 136 133
|
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138 17 134 133
|
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139 17 135 133
|
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140 25 136 137
|
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141 26 137 138
|
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142 26 137 141
|
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143 27 139 138
|
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144 27 140 138
|
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145 27 142 141
|
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146 27 143 141
|
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147 13 146 144
|
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148 14 145 144
|
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149 3 146 148
|
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150 15 146 150
|
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151 5 146 147
|
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152 6 148 149
|
|
153 7 148 155
|
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154 21 153 150
|
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155 17 151 150
|
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156 17 152 150
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157 11 153 154
|
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158 13 157 155
|
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159 14 156 155
|
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160 3 157 159
|
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161 15 157 161
|
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162 5 157 158
|
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163 6 159 160
|
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164 7 159 169
|
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165 28 164 161
|
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166 17 162 161
|
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167 17 163 161
|
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168 6 164 165
|
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169 29 164 166
|
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170 27 167 166
|
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171 27 168 166
|
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172 13 171 169
|
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173 14 170 169
|
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174 3 171 173
|
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175 15 171 175
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176 5 171 172
|
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177 6 173 174
|
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178 7 173 189
|
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179 30 175 178
|
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180 17 176 175
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181 17 177 175
|
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182 31 178 179
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183 31 178 181
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184 31 179 183
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185 32 180 179
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186 31 181 185
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187 32 182 181
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188 31 183 187
|
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189 32 184 183
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190 31 185 187
|
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191 32 186 185
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192 32 188 187
|
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193 13 191 189
|
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194 14 190 189
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195 3 191 193
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196 15 191 195
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197 5 191 192
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198 6 193 194
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199 7 193 203
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200 28 198 195
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201 17 196 195
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202 17 197 195
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203 6 198 199
|
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204 29 198 200
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205 27 201 200
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206 27 202 200
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207 13 205 203
|
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208 14 204 203
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209 3 205 207
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210 4 205 209
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211 5 205 206
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212 6 207 208
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213 7 207 219
|
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214 8 209 211
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215 8 209 215
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216 10 210 209
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217 12 212 211
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218 12 213 211
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219 12 214 211
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220 12 216 215
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221 12 217 215
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222 12 218 215
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223 13 221 219
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224 14 220 219
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225 3 221 223
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226 15 221 225
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227 5 221 222
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228 6 223 224
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229 7 223 229
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230 16 225 228
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231 17 226 225
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232 17 227 225
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233 18 228 374
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234 13 231 229
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235 14 230 229
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236 3 231 233
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237 15 231 235
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238 5 231 232
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239 6 233 234
|
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240 7 233 252
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241 20 235 238
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242 17 236 235
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243 17 237 235
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244 20 238 241
|
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245 17 239 238
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246 17 240 238
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247 19 244 241
|
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248 17 242 241
|
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249 17 243 241
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250 25 244 245
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251 26 245 246
|
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252 26 245 249
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253 27 247 246
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254 27 248 246
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255 27 250 249
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256 27 251 249
|
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257 13 254 252
|
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258 14 253 252
|
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259 3 254 256
|
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260 15 254 258
|
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261 5 254 255
|
|
262 6 256 257
|
|
263 7 256 271
|
|
264 22 261 258
|
|
265 17 259 258
|
|
266 17 260 258
|
|
267 8 261 263
|
|
268 8 261 267
|
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269 10 262 261
|
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270 12 264 263
|
|
271 12 265 263
|
|
272 12 266 263
|
|
273 12 268 267
|
|
274 12 269 267
|
|
275 12 270 267
|
|
276 13 272 271
|
|
277 19 271 274
|
|
278 3 272 277
|
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279 15 272 279
|
|
280 5 272 273
|
|
281 20 274 282
|
|
282 17 275 274
|
|
283 17 276 274
|
|
284 6 277 278
|
|
285 7 277 285
|
|
286 20 279 282
|
|
287 17 280 279
|
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288 17 281 279
|
|
289 17 283 282
|
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290 17 284 282
|
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291 33 285 287
|
|
292 14 286 285
|
|
293 34 290 287
|
|
294 35 288 287
|
|
295 35 289 287
|
|
296 6 290 291
|
|
297 7 290 292
|
|
298 13 294 292
|
|
299 14 293 292
|
|
300 3 294 296
|
|
301 4 294 298
|
|
302 5 294 295
|
|
303 6 296 297
|
|
304 7 296 306
|
|
305 8 298 302
|
|
306 9 298 300
|
|
307 10 299 298
|
|
308 11 300 301
|
|
309 12 303 302
|
|
310 12 304 302
|
|
311 12 305 302
|
|
312 13 307 306
|
|
313 19 306 309
|
|
314 3 307 312
|
|
315 15 307 314
|
|
316 5 307 308
|
|
317 20 309 317
|
|
318 17 310 309
|
|
319 17 311 309
|
|
320 6 312 313
|
|
321 7 312 320
|
|
322 20 314 317
|
|
323 17 315 314
|
|
324 17 316 314
|
|
325 17 318 317
|
|
326 17 319 317
|
|
327 13 322 320
|
|
328 14 321 320
|
|
329 3 322 324
|
|
330 15 322 326
|
|
331 5 322 323
|
|
332 6 324 325
|
|
333 7 324 336
|
|
334 20 326 329
|
|
335 17 327 326
|
|
336 17 328 326
|
|
337 28 332 329
|
|
338 17 330 329
|
|
339 17 331 329
|
|
340 6 332 333
|
|
341 36 332 334
|
|
342 11 334 335
|
|
343 13 338 336
|
|
344 14 337 336
|
|
345 3 338 340
|
|
346 24 338 342
|
|
347 5 338 339
|
|
348 6 340 341
|
|
349 7 340 346
|
|
350 12 343 342
|
|
351 12 344 342
|
|
352 12 345 342
|
|
353 13 348 346
|
|
354 14 347 346
|
|
355 3 348 350
|
|
356 4 348 352
|
|
357 5 348 349
|
|
358 6 350 351
|
|
359 7 350 365
|
|
360 8 352 357
|
|
361 22 352 354
|
|
362 10 353 352
|
|
363 23 361 354
|
|
364 17 355 354
|
|
365 17 356 354
|
|
366 12 358 357
|
|
367 12 359 357
|
|
368 12 360 357
|
|
369 12 362 361
|
|
370 12 363 361
|
|
371 12 364 361
|
|
372 13 367 365
|
|
373 14 366 365
|
|
374 3 367 369
|
|
375 15 367 371
|
|
376 5 367 368
|
|
377 6 369 370
|
|
378 7 369 375
|
|
379 16 371 374
|
|
380 17 372 371
|
|
381 17 373 371
|
|
382 13 377 375
|
|
383 14 376 375
|
|
384 3 377 379
|
|
385 24 377 381
|
|
386 5 377 378
|
|
387 6 379 380
|
|
388 7 379 385
|
|
389 12 382 381
|
|
390 12 383 381
|
|
391 12 384 381
|
|
392 13 387 385
|
|
393 14 386 385
|
|
394 3 387 389
|
|
395 4 387 391
|
|
396 5 387 388
|
|
397 6 389 390
|
|
398 7 389 399
|
|
399 8 391 395
|
|
400 9 391 393
|
|
401 10 392 391
|
|
402 11 393 394
|
|
403 12 396 395
|
|
404 12 397 395
|
|
405 12 398 395
|
|
406 13 401 399
|
|
407 14 400 399
|
|
408 3 401 403
|
|
409 15 401 405
|
|
410 5 401 402
|
|
411 6 403 404
|
|
412 7 403 420
|
|
413 30 405 408
|
|
414 17 406 405
|
|
415 17 407 405
|
|
416 31 408 409
|
|
417 31 408 411
|
|
418 31 409 413
|
|
419 32 410 409
|
|
420 31 411 415
|
|
421 32 412 411
|
|
422 31 413 417
|
|
423 32 414 413
|
|
424 31 415 417
|
|
425 32 416 415
|
|
426 37 418 417
|
|
427 11 418 419
|
|
428 13 422 420
|
|
429 14 421 420
|
|
430 3 422 424
|
|
431 4 422 426
|
|
432 5 422 423
|
|
433 6 424 425
|
|
434 7 424 434
|
|
435 8 426 430
|
|
436 9 426 428
|
|
437 10 427 426
|
|
438 11 428 429
|
|
439 12 431 430
|
|
440 12 432 430
|
|
441 12 433 430
|
|
442 33 434 436
|
|
443 14 435 434
|
|
444 34 439 436
|
|
445 35 437 436
|
|
446 35 438 436
|
|
447 6 439 440
|
|
448 7 439 441
|
|
449 13 443 441
|
|
450 14 442 441
|
|
451 3 443 445
|
|
452 15 443 447
|
|
453 5 443 444
|
|
454 6 445 446
|
|
455 7 445 451
|
|
456 16 447 450
|
|
457 17 448 447
|
|
458 17 449 447
|
|
459 13 453 451
|
|
460 14 452 451
|
|
461 3 453 455
|
|
462 4 453 457
|
|
463 5 453 454
|
|
464 6 455 456
|
|
465 7 455 470
|
|
466 8 457 462
|
|
467 22 457 459
|
|
468 10 458 457
|
|
469 23 466 459
|
|
470 17 460 459
|
|
471 17 461 459
|
|
472 12 463 462
|
|
473 12 464 462
|
|
474 12 465 462
|
|
475 12 467 466
|
|
476 12 468 466
|
|
477 12 469 466
|
|
478 13 472 470
|
|
479 14 471 470
|
|
480 3 472 474
|
|
481 4 472 476
|
|
482 5 472 473
|
|
483 6 474 475
|
|
484 7 474 489
|
|
485 8 476 481
|
|
486 22 476 478
|
|
487 10 477 476
|
|
488 23 485 478
|
|
489 17 479 478
|
|
490 17 480 478
|
|
491 12 482 481
|
|
492 12 483 481
|
|
493 12 484 481
|
|
494 12 486 485
|
|
495 12 487 485
|
|
496 12 488 485
|
|
497 13 491 489
|
|
498 14 490 489
|
|
499 3 491 493
|
|
500 4 491 495
|
|
501 5 491 492
|
|
502 6 493 494
|
|
503 7 493 508
|
|
504 8 495 500
|
|
505 22 495 497
|
|
506 10 496 495
|
|
507 23 504 497
|
|
508 17 498 497
|
|
509 17 499 497
|
|
510 12 501 500
|
|
511 12 502 500
|
|
512 12 503 500
|
|
513 12 505 504
|
|
514 12 506 504
|
|
515 12 507 504
|
|
516 13 509 508
|
|
517 19 508 511
|
|
518 3 509 514
|
|
519 15 509 516
|
|
520 5 509 510
|
|
521 20 511 519
|
|
522 17 512 511
|
|
523 17 513 511
|
|
524 6 514 515
|
|
525 7 514 522
|
|
526 20 516 519
|
|
527 17 517 516
|
|
528 17 518 516
|
|
529 17 520 519
|
|
530 17 521 519
|
|
531 33 522 524
|
|
532 14 523 522
|
|
533 34 527 524
|
|
534 35 525 524
|
|
535 35 526 524
|
|
536 6 527 528
|
|
537 7 527 529
|
|
538 13 531 529
|
|
539 14 530 529
|
|
540 3 531 533
|
|
541 24 531 535
|
|
542 5 531 532
|
|
543 6 533 534
|
|
544 7 533 539
|
|
545 12 536 535
|
|
546 12 537 535
|
|
547 12 538 535
|
|
548 13 541 539
|
|
549 14 540 539
|
|
550 3 541 543
|
|
551 4 541 545
|
|
552 5 541 542
|
|
553 6 543 544
|
|
554 7 543 553
|
|
555 8 545 549
|
|
556 9 545 547
|
|
557 10 546 545
|
|
558 11 547 548
|
|
559 12 550 549
|
|
560 12 551 549
|
|
561 12 552 549
|
|
562 13 555 553
|
|
563 14 554 553
|
|
564 3 555 557
|
|
565 15 555 559
|
|
566 5 555 556
|
|
567 6 557 558
|
|
568 7 557 563
|
|
569 16 559 562
|
|
570 17 560 559
|
|
571 17 561 559
|
|
572 13 564 563
|
|
573 19 563 566
|
|
574 3 564 569
|
|
575 15 564 571
|
|
576 5 564 565
|
|
577 20 566 574
|
|
578 17 567 566
|
|
579 17 568 566
|
|
580 6 569 570
|
|
581 7 569 577
|
|
582 20 571 574
|
|
583 17 572 571
|
|
584 17 573 571
|
|
585 17 575 574
|
|
586 17 576 574
|
|
587 33 577 579
|
|
588 14 578 577
|
|
589 34 582 579
|
|
590 35 580 579
|
|
591 35 581 579
|
|
592 6 582 583
|
|
593 7 582 584
|
|
594 13 586 584
|
|
595 14 585 584
|
|
596 3 586 588
|
|
597 15 586 590
|
|
598 5 586 587
|
|
599 6 588 589
|
|
600 7 588 597
|
|
601 28 593 590
|
|
602 17 591 590
|
|
603 17 592 590
|
|
604 6 593 594
|
|
605 36 593 595
|
|
606 11 595 596
|
|
607 13 599 597
|
|
608 14 598 597
|
|
609 3 599 601
|
|
610 15 599 603
|
|
611 5 599 600
|
|
612 6 601 602
|
|
613 7 601 618
|
|
614 30 603 606
|
|
615 17 604 603
|
|
616 17 605 603
|
|
617 31 606 607
|
|
618 31 606 609
|
|
619 31 607 611
|
|
620 32 608 607
|
|
621 31 609 613
|
|
622 32 610 609
|
|
623 31 611 615
|
|
624 32 612 611
|
|
625 31 613 615
|
|
626 32 614 613
|
|
627 37 616 615
|
|
628 11 616 617
|
|
629 13 620 618
|
|
630 14 619 618
|
|
631 3 620 622
|
|
632 24 620 624
|
|
633 5 620 621
|
|
634 6 622 623
|
|
635 7 622 628
|
|
636 12 625 624
|
|
637 12 626 624
|
|
638 12 627 624
|
|
639 13 630 628
|
|
640 14 629 628
|
|
641 38 630 632
|
|
642 15 630 635
|
|
643 5 630 631
|
|
644 39 632 633
|
|
645 39 632 634
|
|
646 28 638 635
|
|
647 17 636 635
|
|
648 17 637 635
|
|
649 6 638 639
|
|
650 29 638 640
|
|
651 27 641 640
|
|
652 27 642 640
|
|
|
|
Angles
|
|
|
|
1 1 3 1 5
|
|
2 1 4 1 5
|
|
3 1 2 1 5
|
|
4 2 3 1 4
|
|
5 2 3 1 2
|
|
6 2 4 1 2
|
|
7 3 7 5 9
|
|
8 4 1 5 7
|
|
9 5 6 5 7
|
|
10 6 1 5 9
|
|
11 7 6 5 9
|
|
12 8 1 5 6
|
|
13 9 5 7 8
|
|
14 10 8 7 17
|
|
15 11 5 7 17
|
|
16 12 11 9 13
|
|
17 13 5 9 13
|
|
18 14 10 9 13
|
|
19 15 5 9 11
|
|
20 16 10 9 11
|
|
21 17 5 9 10
|
|
22 18 9 11 12
|
|
23 19 14 13 9
|
|
24 19 15 13 9
|
|
25 19 16 13 9
|
|
26 20 14 13 15
|
|
27 20 14 13 16
|
|
28 20 15 13 16
|
|
29 21 19 17 7
|
|
30 22 18 17 19
|
|
31 23 18 17 7
|
|
32 3 21 19 23
|
|
33 24 21 19 17
|
|
34 5 20 19 21
|
|
35 25 23 19 17
|
|
36 7 20 19 23
|
|
37 26 20 19 17
|
|
38 9 19 21 22
|
|
39 10 22 21 31
|
|
40 11 19 21 31
|
|
41 12 25 23 27
|
|
42 13 19 23 27
|
|
43 14 24 23 27
|
|
44 15 19 23 25
|
|
45 16 24 23 25
|
|
46 17 19 23 24
|
|
47 18 23 25 26
|
|
48 19 28 27 23
|
|
49 19 29 27 23
|
|
50 19 30 27 23
|
|
51 20 28 27 29
|
|
52 20 28 27 30
|
|
53 20 29 27 30
|
|
54 21 33 31 21
|
|
55 22 32 31 33
|
|
56 23 32 31 21
|
|
57 27 35 33 37
|
|
58 24 35 33 31
|
|
59 5 34 33 35
|
|
60 28 31 33 37
|
|
61 29 34 33 37
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690 34 371 374 228
|
|
691 21 377 375 369
|
|
692 22 376 375 377
|
|
693 23 376 375 369
|
|
694 53 379 377 381
|
|
695 24 379 377 375
|
|
696 5 378 377 379
|
|
697 54 381 377 375
|
|
698 55 378 377 381
|
|
699 26 378 377 375
|
|
700 9 377 379 380
|
|
701 10 380 379 385
|
|
702 11 377 379 385
|
|
703 56 377 381 382
|
|
704 56 377 381 383
|
|
705 56 377 381 384
|
|
706 20 382 381 383
|
|
707 20 382 381 384
|
|
708 20 383 381 384
|
|
709 21 387 385 379
|
|
710 22 386 385 387
|
|
711 23 386 385 379
|
|
712 3 389 387 391
|
|
713 24 389 387 385
|
|
714 5 388 387 389
|
|
715 25 391 387 385
|
|
716 7 388 387 391
|
|
717 26 388 387 385
|
|
718 9 387 389 390
|
|
719 10 390 389 399
|
|
720 11 387 389 399
|
|
721 12 393 391 395
|
|
722 13 387 391 395
|
|
723 14 392 391 395
|
|
724 15 387 391 393
|
|
725 16 392 391 393
|
|
726 17 387 391 392
|
|
727 18 391 393 394
|
|
728 19 396 395 391
|
|
729 19 397 395 391
|
|
730 19 398 395 391
|
|
731 20 396 395 397
|
|
732 20 396 395 398
|
|
733 20 397 395 398
|
|
734 21 401 399 389
|
|
735 22 400 399 401
|
|
736 23 400 399 389
|
|
737 27 403 401 405
|
|
738 24 403 401 399
|
|
739 5 402 401 403
|
|
740 28 399 401 405
|
|
741 29 402 401 405
|
|
742 26 402 401 399
|
|
743 9 401 403 404
|
|
744 10 404 403 420
|
|
745 11 401 403 420
|
|
746 68 401 405 408
|
|
747 69 406 405 408
|
|
748 69 407 405 408
|
|
749 32 401 405 406
|
|
750 32 401 405 407
|
|
751 33 406 405 407
|
|
752 70 409 408 411
|
|
753 71 405 408 409
|
|
754 71 405 408 411
|
|
755 70 413 409 408
|
|
756 72 410 409 413
|
|
757 72 410 409 408
|
|
758 70 408 411 415
|
|
759 72 412 411 408
|
|
760 72 412 411 415
|
|
761 70 417 413 409
|
|
762 72 414 413 417
|
|
763 72 414 413 409
|
|
764 70 411 415 417
|
|
765 72 416 415 411
|
|
766 72 416 415 417
|
|
767 86 418 417 415
|
|
768 86 418 417 413
|
|
769 70 415 417 413
|
|
770 87 419 418 417
|
|
771 21 422 420 403
|
|
772 22 421 420 422
|
|
773 23 421 420 403
|
|
774 3 424 422 426
|
|
775 24 424 422 420
|
|
776 5 423 422 424
|
|
777 25 426 422 420
|
|
778 7 423 422 426
|
|
779 26 423 422 420
|
|
780 9 422 424 425
|
|
781 10 425 424 434
|
|
782 11 422 424 434
|
|
783 12 428 426 430
|
|
784 13 422 426 430
|
|
785 14 427 426 430
|
|
786 15 422 426 428
|
|
787 16 427 426 428
|
|
788 17 422 426 427
|
|
789 18 426 428 429
|
|
790 19 431 430 426
|
|
791 19 432 430 426
|
|
792 19 433 430 426
|
|
793 20 431 430 432
|
|
794 20 431 430 433
|
|
795 20 432 430 433
|
|
796 74 424 434 436
|
|
797 75 435 434 436
|
|
798 23 435 434 424
|
|
799 76 439 436 434
|
|
800 77 437 436 439
|
|
801 77 438 436 439
|
|
802 78 437 436 434
|
|
803 78 438 436 434
|
|
804 79 437 436 438
|
|
805 80 440 439 436
|
|
806 10 440 439 441
|
|
807 81 441 439 436
|
|
808 21 443 441 439
|
|
809 22 442 441 443
|
|
810 23 442 441 439
|
|
811 27 445 443 447
|
|
812 24 445 443 441
|
|
813 5 444 443 445
|
|
814 28 441 443 447
|
|
815 29 444 443 447
|
|
816 26 444 443 441
|
|
817 9 443 445 446
|
|
818 10 446 445 451
|
|
819 11 443 445 451
|
|
820 30 443 447 450
|
|
821 31 448 447 450
|
|
822 31 449 447 450
|
|
823 32 443 447 448
|
|
824 32 443 447 449
|
|
825 33 448 447 449
|
|
826 34 447 450 50
|
|
827 21 453 451 445
|
|
828 22 452 451 453
|
|
829 23 452 451 445
|
|
830 3 455 453 457
|
|
831 24 455 453 451
|
|
832 5 454 453 455
|
|
833 25 457 453 451
|
|
834 7 454 453 457
|
|
835 26 454 453 451
|
|
836 9 453 455 456
|
|
837 10 456 455 470
|
|
838 11 453 455 470
|
|
839 45 462 457 459
|
|
840 13 453 457 462
|
|
841 14 458 457 462
|
|
842 46 453 457 459
|
|
843 47 458 457 459
|
|
844 17 453 457 458
|
|
845 48 457 459 466
|
|
846 49 460 459 466
|
|
847 49 461 459 466
|
|
848 50 460 459 457
|
|
849 50 461 459 457
|
|
850 33 460 459 461
|
|
851 19 463 462 457
|
|
852 19 464 462 457
|
|
853 19 465 462 457
|
|
854 20 463 462 464
|
|
855 20 463 462 465
|
|
856 20 464 462 465
|
|
857 51 467 466 459
|
|
858 51 468 466 459
|
|
859 51 469 466 459
|
|
860 20 467 466 468
|
|
861 20 467 466 469
|
|
862 20 468 466 469
|
|
863 21 472 470 455
|
|
864 22 471 470 472
|
|
865 23 471 470 455
|
|
866 3 474 472 476
|
|
867 24 474 472 470
|
|
868 5 473 472 474
|
|
869 25 476 472 470
|
|
870 7 473 472 476
|
|
871 26 473 472 470
|
|
872 9 472 474 475
|
|
873 10 475 474 489
|
|
874 11 472 474 489
|
|
875 45 481 476 478
|
|
876 13 472 476 481
|
|
877 14 477 476 481
|
|
878 46 472 476 478
|
|
879 47 477 476 478
|
|
880 17 472 476 477
|
|
881 48 476 478 485
|
|
882 49 479 478 485
|
|
883 49 480 478 485
|
|
884 50 479 478 476
|
|
885 50 480 478 476
|
|
886 33 479 478 480
|
|
887 19 482 481 476
|
|
888 19 483 481 476
|
|
889 19 484 481 476
|
|
890 20 482 481 483
|
|
891 20 482 481 484
|
|
892 20 483 481 484
|
|
893 51 486 485 478
|
|
894 51 487 485 478
|
|
895 51 488 485 478
|
|
896 20 486 485 487
|
|
897 20 486 485 488
|
|
898 20 487 485 488
|
|
899 21 491 489 474
|
|
900 22 490 489 491
|
|
901 23 490 489 474
|
|
902 3 493 491 495
|
|
903 24 493 491 489
|
|
904 5 492 491 493
|
|
905 25 495 491 489
|
|
906 7 492 491 495
|
|
907 26 492 491 489
|
|
908 9 491 493 494
|
|
909 10 494 493 508
|
|
910 11 491 493 508
|
|
911 45 500 495 497
|
|
912 13 491 495 500
|
|
913 14 496 495 500
|
|
914 46 491 495 497
|
|
915 47 496 495 497
|
|
916 17 491 495 496
|
|
917 48 495 497 504
|
|
918 49 498 497 504
|
|
919 49 499 497 504
|
|
920 50 498 497 495
|
|
921 50 499 497 495
|
|
922 33 498 497 499
|
|
923 19 501 500 495
|
|
924 19 502 500 495
|
|
925 19 503 500 495
|
|
926 20 501 500 502
|
|
927 20 501 500 503
|
|
928 20 502 500 503
|
|
929 51 505 504 497
|
|
930 51 506 504 497
|
|
931 51 507 504 497
|
|
932 20 505 504 506
|
|
933 20 505 504 507
|
|
934 20 506 504 507
|
|
935 35 509 508 511
|
|
936 21 509 508 493
|
|
937 36 493 508 511
|
|
938 27 514 509 516
|
|
939 24 514 509 508
|
|
940 5 510 509 514
|
|
941 28 508 509 516
|
|
942 29 510 509 516
|
|
943 26 510 509 508
|
|
944 37 508 511 519
|
|
945 38 512 511 508
|
|
946 38 513 511 508
|
|
947 39 512 511 519
|
|
948 39 513 511 519
|
|
949 33 512 511 513
|
|
950 9 509 514 515
|
|
951 10 515 514 522
|
|
952 11 509 514 522
|
|
953 40 509 516 519
|
|
954 39 517 516 519
|
|
955 39 518 516 519
|
|
956 32 509 516 517
|
|
957 32 509 516 518
|
|
958 33 517 516 518
|
|
959 41 511 519 516
|
|
960 39 520 519 511
|
|
961 39 521 519 511
|
|
962 39 520 519 516
|
|
963 39 521 519 516
|
|
964 33 520 519 521
|
|
965 74 514 522 524
|
|
966 75 523 522 524
|
|
967 23 523 522 514
|
|
968 76 527 524 522
|
|
969 77 525 524 527
|
|
970 77 526 524 527
|
|
971 78 525 524 522
|
|
972 78 526 524 522
|
|
973 79 525 524 526
|
|
974 80 528 527 524
|
|
975 10 528 527 529
|
|
976 81 529 527 524
|
|
977 21 531 529 527
|
|
978 22 530 529 531
|
|
979 23 530 529 527
|
|
980 53 533 531 535
|
|
981 24 533 531 529
|
|
982 5 532 531 533
|
|
983 54 535 531 529
|
|
984 55 532 531 535
|
|
985 26 532 531 529
|
|
986 9 531 533 534
|
|
987 10 534 533 539
|
|
988 11 531 533 539
|
|
989 56 531 535 536
|
|
990 56 531 535 537
|
|
991 56 531 535 538
|
|
992 20 536 535 537
|
|
993 20 536 535 538
|
|
994 20 537 535 538
|
|
995 21 541 539 533
|
|
996 22 540 539 541
|
|
997 23 540 539 533
|
|
998 3 543 541 545
|
|
999 24 543 541 539
|
|
1000 5 542 541 543
|
|
1001 25 545 541 539
|
|
1002 7 542 541 545
|
|
1003 26 542 541 539
|
|
1004 9 541 543 544
|
|
1005 10 544 543 553
|
|
1006 11 541 543 553
|
|
1007 12 547 545 549
|
|
1008 13 541 545 549
|
|
1009 14 546 545 549
|
|
1010 15 541 545 547
|
|
1011 16 546 545 547
|
|
1012 17 541 545 546
|
|
1013 18 545 547 548
|
|
1014 19 550 549 545
|
|
1015 19 551 549 545
|
|
1016 19 552 549 545
|
|
1017 20 550 549 551
|
|
1018 20 550 549 552
|
|
1019 20 551 549 552
|
|
1020 21 555 553 543
|
|
1021 22 554 553 555
|
|
1022 23 554 553 543
|
|
1023 27 557 555 559
|
|
1024 24 557 555 553
|
|
1025 5 556 555 557
|
|
1026 28 553 555 559
|
|
1027 29 556 555 559
|
|
1028 26 556 555 553
|
|
1029 9 555 557 558
|
|
1030 10 558 557 563
|
|
1031 11 555 557 563
|
|
1032 30 555 559 562
|
|
1033 31 560 559 562
|
|
1034 31 561 559 562
|
|
1035 32 555 559 560
|
|
1036 32 555 559 561
|
|
1037 33 560 559 561
|
|
1038 34 559 562 40
|
|
1039 35 564 563 566
|
|
1040 21 564 563 557
|
|
1041 36 557 563 566
|
|
1042 27 569 564 571
|
|
1043 24 569 564 563
|
|
1044 5 565 564 569
|
|
1045 28 563 564 571
|
|
1046 29 565 564 571
|
|
1047 26 565 564 563
|
|
1048 37 563 566 574
|
|
1049 38 567 566 563
|
|
1050 38 568 566 563
|
|
1051 39 567 566 574
|
|
1052 39 568 566 574
|
|
1053 33 567 566 568
|
|
1054 9 564 569 570
|
|
1055 10 570 569 577
|
|
1056 11 564 569 577
|
|
1057 40 564 571 574
|
|
1058 39 572 571 574
|
|
1059 39 573 571 574
|
|
1060 32 564 571 572
|
|
1061 32 564 571 573
|
|
1062 33 572 571 573
|
|
1063 41 566 574 571
|
|
1064 39 575 574 566
|
|
1065 39 576 574 566
|
|
1066 39 575 574 571
|
|
1067 39 576 574 571
|
|
1068 33 575 574 576
|
|
1069 74 569 577 579
|
|
1070 75 578 577 579
|
|
1071 23 578 577 569
|
|
1072 76 582 579 577
|
|
1073 77 580 579 582
|
|
1074 77 581 579 582
|
|
1075 78 580 579 577
|
|
1076 78 581 579 577
|
|
1077 79 580 579 581
|
|
1078 80 583 582 579
|
|
1079 10 583 582 584
|
|
1080 81 584 582 579
|
|
1081 21 586 584 582
|
|
1082 22 585 584 586
|
|
1083 23 585 584 582
|
|
1084 27 588 586 590
|
|
1085 24 588 586 584
|
|
1086 5 587 586 588
|
|
1087 28 584 586 590
|
|
1088 29 587 586 590
|
|
1089 26 587 586 584
|
|
1090 9 586 588 589
|
|
1091 10 589 588 597
|
|
1092 11 586 588 597
|
|
1093 62 586 590 593
|
|
1094 63 591 590 593
|
|
1095 63 592 590 593
|
|
1096 32 586 590 591
|
|
1097 32 586 590 592
|
|
1098 33 591 590 592
|
|
1099 83 594 593 595
|
|
1100 65 594 593 590
|
|
1101 84 595 593 590
|
|
1102 85 593 595 596
|
|
1103 21 599 597 588
|
|
1104 22 598 597 599
|
|
1105 23 598 597 588
|
|
1106 27 601 599 603
|
|
1107 24 601 599 597
|
|
1108 5 600 599 601
|
|
1109 28 597 599 603
|
|
1110 29 600 599 603
|
|
1111 26 600 599 597
|
|
1112 9 599 601 602
|
|
1113 10 602 601 618
|
|
1114 11 599 601 618
|
|
1115 68 599 603 606
|
|
1116 69 604 603 606
|
|
1117 69 605 603 606
|
|
1118 32 599 603 604
|
|
1119 32 599 603 605
|
|
1120 33 604 603 605
|
|
1121 70 607 606 609
|
|
1122 71 603 606 607
|
|
1123 71 603 606 609
|
|
1124 70 611 607 606
|
|
1125 72 608 607 611
|
|
1126 72 608 607 606
|
|
1127 70 606 609 613
|
|
1128 72 610 609 606
|
|
1129 72 610 609 613
|
|
1130 70 615 611 607
|
|
1131 72 612 611 615
|
|
1132 72 612 611 607
|
|
1133 70 609 613 615
|
|
1134 72 614 613 609
|
|
1135 72 614 613 615
|
|
1136 86 616 615 613
|
|
1137 86 616 615 611
|
|
1138 70 613 615 611
|
|
1139 87 617 616 615
|
|
1140 21 620 618 601
|
|
1141 22 619 618 620
|
|
1142 23 619 618 601
|
|
1143 53 622 620 624
|
|
1144 24 622 620 618
|
|
1145 5 621 620 622
|
|
1146 54 624 620 618
|
|
1147 55 621 620 624
|
|
1148 26 621 620 618
|
|
1149 9 620 622 623
|
|
1150 10 623 622 628
|
|
1151 11 620 622 628
|
|
1152 56 620 624 625
|
|
1153 56 620 624 626
|
|
1154 56 620 624 627
|
|
1155 20 625 624 626
|
|
1156 20 625 624 627
|
|
1157 20 626 624 627
|
|
1158 21 630 628 622
|
|
1159 22 629 628 630
|
|
1160 23 629 628 622
|
|
1161 88 635 630 632
|
|
1162 89 628 630 632
|
|
1163 90 631 630 632
|
|
1164 28 628 630 635
|
|
1165 29 631 630 635
|
|
1166 26 631 630 628
|
|
1167 91 633 632 634
|
|
1168 92 630 632 633
|
|
1169 92 630 632 634
|
|
1170 62 630 635 638
|
|
1171 63 636 635 638
|
|
1172 63 637 635 638
|
|
1173 32 630 635 636
|
|
1174 32 630 635 637
|
|
1175 33 636 635 637
|
|
1176 64 639 638 640
|
|
1177 65 639 638 635
|
|
1178 66 635 638 640
|
|
1179 67 641 640 638
|
|
1180 67 642 640 638
|
|
1181 61 641 640 642
|
|
|
|
Dihedrals
|
|
|
|
1 1 3 1 5 7
|
|
2 2 3 1 5 9
|
|
3 3 3 1 5 6
|
|
4 1 4 1 5 7
|
|
5 2 4 1 5 9
|
|
6 3 4 1 5 6
|
|
7 1 2 1 5 7
|
|
8 2 2 1 5 9
|
|
9 3 2 1 5 6
|
|
10 4 9 5 7 8
|
|
11 5 9 5 7 17
|
|
12 6 1 5 7 8
|
|
13 7 1 5 7 17
|
|
14 8 6 5 7 8
|
|
15 9 6 5 7 17
|
|
16 10 7 5 9 13
|
|
17 11 7 5 9 11
|
|
18 12 7 5 9 10
|
|
19 13 1 5 9 13
|
|
20 14 1 5 9 11
|
|
21 15 1 5 9 10
|
|
22 16 6 5 9 13
|
|
23 17 6 5 9 11
|
|
24 18 6 5 9 10
|
|
25 19 8 7 17 19
|
|
26 20 8 7 17 18
|
|
27 21 5 7 17 19
|
|
28 22 5 7 17 18
|
|
29 23 11 9 13 14
|
|
30 23 11 9 13 15
|
|
31 23 11 9 13 16
|
|
32 24 5 9 13 14
|
|
33 24 5 9 13 15
|
|
34 24 5 9 13 16
|
|
35 25 10 9 13 14
|
|
36 25 10 9 13 15
|
|
37 25 10 9 13 16
|
|
38 26 13 9 11 12
|
|
39 27 5 9 11 12
|
|
40 28 10 9 11 12
|
|
41 29 21 19 17 7
|
|
42 30 23 19 17 7
|
|
43 31 20 19 17 7
|
|
44 32 21 19 17 18
|
|
45 33 23 19 17 18
|
|
46 34 20 19 17 18
|
|
47 4 23 19 21 22
|
|
48 5 23 19 21 31
|
|
49 35 17 19 21 22
|
|
50 36 17 19 21 31
|
|
51 8 20 19 21 22
|
|
52 9 20 19 21 31
|
|
53 10 21 19 23 27
|
|
54 11 21 19 23 25
|
|
55 12 21 19 23 24
|
|
56 37 17 19 23 27
|
|
57 38 17 19 23 25
|
|
58 39 17 19 23 24
|
|
59 16 20 19 23 27
|
|
60 17 20 19 23 25
|
|
61 18 20 19 23 24
|
|
62 19 22 21 31 33
|
|
63 20 22 21 31 32
|
|
64 21 19 21 31 33
|
|
65 22 19 21 31 32
|
|
66 23 25 23 27 28
|
|
67 23 25 23 27 29
|
|
68 23 25 23 27 30
|
|
69 24 19 23 27 28
|
|
70 24 19 23 27 29
|
|
71 24 19 23 27 30
|
|
72 25 24 23 27 28
|
|
73 25 24 23 27 29
|
|
74 25 24 23 27 30
|
|
75 26 27 23 25 26
|
|
76 27 19 23 25 26
|
|
77 28 24 23 25 26
|
|
78 29 35 33 31 21
|
|
79 40 37 33 31 21
|
|
80 31 34 33 31 21
|
|
81 32 35 33 31 32
|
|
82 41 37 33 31 32
|
|
83 34 34 33 31 32
|
|
84 42 37 33 35 36
|
|
85 43 37 33 35 41
|
|
86 35 31 33 35 36
|
|
87 36 31 33 35 41
|
|
88 8 34 33 35 36
|
|
89 9 34 33 35 41
|
|
90 44 35 33 37 40
|
|
91 45 35 33 37 38
|
|
92 45 35 33 37 39
|
|
93 46 31 33 37 40
|
|
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1021 89 381 377 375 369
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1097 111 399 401 405 408
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1100 112 402 401 405 408
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1101 49 402 401 405 406
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1103 19 404 403 420 422
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1123 116 410 409 413 417
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|
|
1238 16 454 453 457 462
|
|
1239 78 454 453 457 459
|
|
1240 18 454 453 457 458
|
|
1241 19 456 455 470 472
|
|
1242 20 456 455 470 471
|
|
1243 21 453 455 470 472
|
|
1244 22 453 455 470 471
|
|
1245 79 459 457 462 463
|
|
1246 79 459 457 462 464
|
|
1247 79 459 457 462 465
|
|
1248 24 453 457 462 463
|
|
1249 24 453 457 462 464
|
|
1250 24 453 457 462 465
|
|
1251 25 458 457 462 463
|
|
1252 25 458 457 462 464
|
|
1253 25 458 457 462 465
|
|
1254 80 462 457 459 466
|
|
1255 81 462 457 459 460
|
|
1256 81 462 457 459 461
|
|
1257 82 453 457 459 466
|
|
1258 83 453 457 459 460
|
|
1259 83 453 457 459 461
|
|
1260 84 458 457 459 466
|
|
1261 85 458 457 459 460
|
|
1262 85 458 457 459 461
|
|
1263 86 467 466 459 457
|
|
1264 86 468 466 459 457
|
|
1265 86 469 466 459 457
|
|
1266 87 467 466 459 460
|
|
1267 87 468 466 459 460
|
|
1268 87 469 466 459 460
|
|
1269 87 467 466 459 461
|
|
1270 87 468 466 459 461
|
|
1271 87 469 466 459 461
|
|
1272 29 474 472 470 455
|
|
1273 30 476 472 470 455
|
|
1274 31 473 472 470 455
|
|
1275 32 474 472 470 471
|
|
1276 33 476 472 470 471
|
|
1277 34 473 472 470 471
|
|
1278 4 476 472 474 475
|
|
1279 5 476 472 474 489
|
|
1280 35 470 472 474 475
|
|
1281 36 470 472 474 489
|
|
1282 8 473 472 474 475
|
|
1283 9 473 472 474 489
|
|
1284 10 474 472 476 481
|
|
1285 76 474 472 476 478
|
|
1286 12 474 472 476 477
|
|
1287 37 470 472 476 481
|
|
1288 77 470 472 476 478
|
|
1289 39 470 472 476 477
|
|
1290 16 473 472 476 481
|
|
1291 78 473 472 476 478
|
|
1292 18 473 472 476 477
|
|
1293 19 475 474 489 491
|
|
1294 20 475 474 489 490
|
|
1295 21 472 474 489 491
|
|
1296 22 472 474 489 490
|
|
1297 79 478 476 481 482
|
|
1298 79 478 476 481 483
|
|
1299 79 478 476 481 484
|
|
1300 24 472 476 481 482
|
|
1301 24 472 476 481 483
|
|
1302 24 472 476 481 484
|
|
1303 25 477 476 481 482
|
|
1304 25 477 476 481 483
|
|
1305 25 477 476 481 484
|
|
1306 80 481 476 478 485
|
|
1307 81 481 476 478 479
|
|
1308 81 481 476 478 480
|
|
1309 82 472 476 478 485
|
|
1310 83 472 476 478 479
|
|
1311 83 472 476 478 480
|
|
1312 84 477 476 478 485
|
|
1313 85 477 476 478 479
|
|
1314 85 477 476 478 480
|
|
1315 86 486 485 478 476
|
|
1316 86 487 485 478 476
|
|
1317 86 488 485 478 476
|
|
1318 87 486 485 478 479
|
|
1319 87 487 485 478 479
|
|
1320 87 488 485 478 479
|
|
1321 87 486 485 478 480
|
|
1322 87 487 485 478 480
|
|
1323 87 488 485 478 480
|
|
1324 29 493 491 489 474
|
|
1325 30 495 491 489 474
|
|
1326 31 492 491 489 474
|
|
1327 32 493 491 489 490
|
|
1328 33 495 491 489 490
|
|
1329 34 492 491 489 490
|
|
1330 4 495 491 493 494
|
|
1331 5 495 491 493 508
|
|
1332 35 489 491 493 494
|
|
1333 36 489 491 493 508
|
|
1334 8 492 491 493 494
|
|
1335 9 492 491 493 508
|
|
1336 10 493 491 495 500
|
|
1337 76 493 491 495 497
|
|
1338 12 493 491 495 496
|
|
1339 37 489 491 495 500
|
|
1340 77 489 491 495 497
|
|
1341 39 489 491 495 496
|
|
1342 16 492 491 495 500
|
|
1343 78 492 491 495 497
|
|
1344 18 492 491 495 496
|
|
1345 19 494 493 508 509
|
|
1346 53 494 493 508 511
|
|
1347 21 491 493 508 509
|
|
1348 54 491 493 508 511
|
|
1349 79 497 495 500 501
|
|
1350 79 497 495 500 502
|
|
1351 79 497 495 500 503
|
|
1352 24 491 495 500 501
|
|
1353 24 491 495 500 502
|
|
1354 24 491 495 500 503
|
|
1355 25 496 495 500 501
|
|
1356 25 496 495 500 502
|
|
1357 25 496 495 500 503
|
|
1358 80 500 495 497 504
|
|
1359 81 500 495 497 498
|
|
1360 81 500 495 497 499
|
|
1361 82 491 495 497 504
|
|
1362 83 491 495 497 498
|
|
1363 83 491 495 497 499
|
|
1364 84 496 495 497 504
|
|
1365 85 496 495 497 498
|
|
1366 85 496 495 497 499
|
|
1367 86 505 504 497 495
|
|
1368 86 506 504 497 495
|
|
1369 86 507 504 497 495
|
|
1370 87 505 504 497 498
|
|
1371 87 506 504 497 498
|
|
1372 87 507 504 497 498
|
|
1373 87 505 504 497 499
|
|
1374 87 506 504 497 499
|
|
1375 87 507 504 497 499
|
|
1376 55 514 509 508 511
|
|
1377 56 516 509 508 511
|
|
1378 57 510 509 508 511
|
|
1379 29 514 509 508 493
|
|
1380 40 516 509 508 493
|
|
1381 31 510 509 508 493
|
|
1382 58 509 508 511 519
|
|
1383 59 509 508 511 512
|
|
1384 59 509 508 511 513
|
|
1385 60 493 508 511 519
|
|
1386 61 493 508 511 512
|
|
1387 61 493 508 511 513
|
|
1388 42 516 509 514 515
|
|
1389 43 516 509 514 522
|
|
1390 35 508 509 514 515
|
|
1391 36 508 509 514 522
|
|
1392 8 510 509 514 515
|
|
1393 9 510 509 514 522
|
|
1394 62 514 509 516 519
|
|
1395 45 514 509 516 517
|
|
1396 45 514 509 516 518
|
|
1397 63 508 509 516 519
|
|
1398 47 508 509 516 517
|
|
1399 47 508 509 516 518
|
|
1400 64 510 509 516 519
|
|
1401 49 510 509 516 517
|
|
1402 49 510 509 516 518
|
|
1403 65 508 511 519 516
|
|
1404 66 520 519 511 508
|
|
1405 66 521 519 511 508
|
|
1406 67 512 511 519 516
|
|
1407 68 512 511 519 520
|
|
1408 68 512 511 519 521
|
|
1409 67 513 511 519 516
|
|
1410 68 513 511 519 520
|
|
1411 68 513 511 519 521
|
|
1412 125 515 514 522 524
|
|
1413 20 515 514 522 523
|
|
1414 126 509 514 522 524
|
|
1415 22 509 514 522 523
|
|
1416 69 509 516 519 511
|
|
1417 70 509 516 519 520
|
|
1418 70 509 516 519 521
|
|
1419 67 517 516 519 511
|
|
1420 68 517 516 519 520
|
|
1421 68 517 516 519 521
|
|
1422 67 518 516 519 511
|
|
1423 68 518 516 519 520
|
|
1424 68 518 516 519 521
|
|
1425 127 514 522 524 527
|
|
1426 128 514 522 524 525
|
|
1427 128 514 522 524 526
|
|
1428 129 523 522 524 527
|
|
1429 130 523 522 524 525
|
|
1430 130 523 522 524 526
|
|
1431 131 528 527 524 522
|
|
1432 132 529 527 524 522
|
|
1433 133 528 527 524 525
|
|
1434 134 529 527 524 525
|
|
1435 133 528 527 524 526
|
|
1436 134 529 527 524 526
|
|
1437 19 528 527 529 531
|
|
1438 20 528 527 529 530
|
|
1439 135 524 527 529 531
|
|
1440 136 524 527 529 530
|
|
1441 29 533 531 529 527
|
|
1442 89 535 531 529 527
|
|
1443 31 532 531 529 527
|
|
1444 32 533 531 529 530
|
|
1445 90 535 531 529 530
|
|
1446 34 532 531 529 530
|
|
1447 91 535 531 533 534
|
|
1448 92 535 531 533 539
|
|
1449 35 529 531 533 534
|
|
1450 36 529 531 533 539
|
|
1451 8 532 531 533 534
|
|
1452 9 532 531 533 539
|
|
1453 93 533 531 535 536
|
|
1454 93 533 531 535 537
|
|
1455 93 533 531 535 538
|
|
1456 94 529 531 535 536
|
|
1457 94 529 531 535 537
|
|
1458 94 529 531 535 538
|
|
1459 95 532 531 535 536
|
|
1460 95 532 531 535 537
|
|
1461 95 532 531 535 538
|
|
1462 19 534 533 539 541
|
|
1463 20 534 533 539 540
|
|
1464 21 531 533 539 541
|
|
1465 22 531 533 539 540
|
|
1466 29 543 541 539 533
|
|
1467 30 545 541 539 533
|
|
1468 31 542 541 539 533
|
|
1469 32 543 541 539 540
|
|
1470 33 545 541 539 540
|
|
1471 34 542 541 539 540
|
|
1472 4 545 541 543 544
|
|
1473 5 545 541 543 553
|
|
1474 35 539 541 543 544
|
|
1475 36 539 541 543 553
|
|
1476 8 542 541 543 544
|
|
1477 9 542 541 543 553
|
|
1478 10 543 541 545 549
|
|
1479 11 543 541 545 547
|
|
1480 12 543 541 545 546
|
|
1481 37 539 541 545 549
|
|
1482 38 539 541 545 547
|
|
1483 39 539 541 545 546
|
|
1484 16 542 541 545 549
|
|
1485 17 542 541 545 547
|
|
1486 18 542 541 545 546
|
|
1487 19 544 543 553 555
|
|
1488 20 544 543 553 554
|
|
1489 21 541 543 553 555
|
|
1490 22 541 543 553 554
|
|
1491 23 547 545 549 550
|
|
1492 23 547 545 549 551
|
|
1493 23 547 545 549 552
|
|
1494 24 541 545 549 550
|
|
1495 24 541 545 549 551
|
|
1496 24 541 545 549 552
|
|
1497 25 546 545 549 550
|
|
1498 25 546 545 549 551
|
|
1499 25 546 545 549 552
|
|
1500 26 549 545 547 548
|
|
1501 27 541 545 547 548
|
|
1502 28 546 545 547 548
|
|
1503 29 557 555 553 543
|
|
1504 40 559 555 553 543
|
|
1505 31 556 555 553 543
|
|
1506 32 557 555 553 554
|
|
1507 41 559 555 553 554
|
|
1508 34 556 555 553 554
|
|
1509 42 559 555 557 558
|
|
1510 43 559 555 557 563
|
|
1511 35 553 555 557 558
|
|
1512 36 553 555 557 563
|
|
1513 8 556 555 557 558
|
|
1514 9 556 555 557 563
|
|
1515 44 557 555 559 562
|
|
1516 45 557 555 559 560
|
|
1517 45 557 555 559 561
|
|
1518 46 553 555 559 562
|
|
1519 47 553 555 559 560
|
|
1520 47 553 555 559 561
|
|
1521 48 556 555 559 562
|
|
1522 49 556 555 559 560
|
|
1523 49 556 555 559 561
|
|
1524 19 558 557 563 564
|
|
1525 53 558 557 563 566
|
|
1526 21 555 557 563 564
|
|
1527 54 555 557 563 566
|
|
1528 50 555 559 562 40
|
|
1529 51 560 559 562 40
|
|
1530 51 561 559 562 40
|
|
1531 55 569 564 563 566
|
|
1532 56 571 564 563 566
|
|
1533 57 565 564 563 566
|
|
1534 29 569 564 563 557
|
|
1535 40 571 564 563 557
|
|
1536 31 565 564 563 557
|
|
1537 58 564 563 566 574
|
|
1538 59 564 563 566 567
|
|
1539 59 564 563 566 568
|
|
1540 60 557 563 566 574
|
|
1541 61 557 563 566 567
|
|
1542 61 557 563 566 568
|
|
1543 42 571 564 569 570
|
|
1544 43 571 564 569 577
|
|
1545 35 563 564 569 570
|
|
1546 36 563 564 569 577
|
|
1547 8 565 564 569 570
|
|
1548 9 565 564 569 577
|
|
1549 62 569 564 571 574
|
|
1550 45 569 564 571 572
|
|
1551 45 569 564 571 573
|
|
1552 63 563 564 571 574
|
|
1553 47 563 564 571 572
|
|
1554 47 563 564 571 573
|
|
1555 64 565 564 571 574
|
|
1556 49 565 564 571 572
|
|
1557 49 565 564 571 573
|
|
1558 65 563 566 574 571
|
|
1559 66 575 574 566 563
|
|
1560 66 576 574 566 563
|
|
1561 67 567 566 574 571
|
|
1562 68 567 566 574 575
|
|
1563 68 567 566 574 576
|
|
1564 67 568 566 574 571
|
|
1565 68 568 566 574 575
|
|
1566 68 568 566 574 576
|
|
1567 125 570 569 577 579
|
|
1568 20 570 569 577 578
|
|
1569 126 564 569 577 579
|
|
1570 22 564 569 577 578
|
|
1571 69 564 571 574 566
|
|
1572 70 564 571 574 575
|
|
1573 70 564 571 574 576
|
|
1574 67 572 571 574 566
|
|
1575 68 572 571 574 575
|
|
1576 68 572 571 574 576
|
|
1577 67 573 571 574 566
|
|
1578 68 573 571 574 575
|
|
1579 68 573 571 574 576
|
|
1580 127 569 577 579 582
|
|
1581 128 569 577 579 580
|
|
1582 128 569 577 579 581
|
|
1583 129 578 577 579 582
|
|
1584 130 578 577 579 580
|
|
1585 130 578 577 579 581
|
|
1586 131 583 582 579 577
|
|
1587 132 584 582 579 577
|
|
1588 133 583 582 579 580
|
|
1589 134 584 582 579 580
|
|
1590 133 583 582 579 581
|
|
1591 134 584 582 579 581
|
|
1592 19 583 582 584 586
|
|
1593 20 583 582 584 585
|
|
1594 135 579 582 584 586
|
|
1595 136 579 582 584 585
|
|
1596 29 588 586 584 582
|
|
1597 40 590 586 584 582
|
|
1598 31 587 586 584 582
|
|
1599 32 588 586 584 585
|
|
1600 41 590 586 584 585
|
|
1601 34 587 586 584 585
|
|
1602 42 590 586 588 589
|
|
1603 43 590 586 588 597
|
|
1604 35 584 586 588 589
|
|
1605 36 584 586 588 597
|
|
1606 8 587 586 588 589
|
|
1607 9 587 586 588 597
|
|
1608 101 588 586 590 593
|
|
1609 45 588 586 590 591
|
|
1610 45 588 586 590 592
|
|
1611 102 584 586 590 593
|
|
1612 47 584 586 590 591
|
|
1613 47 584 586 590 592
|
|
1614 103 587 586 590 593
|
|
1615 49 587 586 590 591
|
|
1616 49 587 586 590 592
|
|
1617 19 589 588 597 599
|
|
1618 20 589 588 597 598
|
|
1619 21 586 588 597 599
|
|
1620 22 586 588 597 598
|
|
1621 104 594 593 590 586
|
|
1622 147 595 593 590 586
|
|
1623 106 594 593 590 591
|
|
1624 141 595 593 590 591
|
|
1625 106 594 593 590 592
|
|
1626 141 595 593 590 592
|
|
1627 142 594 593 595 596
|
|
1628 143 590 593 595 596
|
|
1629 29 601 599 597 588
|
|
1630 40 603 599 597 588
|
|
1631 31 600 599 597 588
|
|
1632 32 601 599 597 598
|
|
1633 41 603 599 597 598
|
|
1634 34 600 599 597 598
|
|
1635 42 603 599 601 602
|
|
1636 43 603 599 601 618
|
|
1637 35 597 599 601 602
|
|
1638 36 597 599 601 618
|
|
1639 8 600 599 601 602
|
|
1640 9 600 599 601 618
|
|
1641 110 601 599 603 606
|
|
1642 45 601 599 603 604
|
|
1643 45 601 599 603 605
|
|
1644 111 597 599 603 606
|
|
1645 47 597 599 603 604
|
|
1646 47 597 599 603 605
|
|
1647 112 600 599 603 606
|
|
1648 49 600 599 603 604
|
|
1649 49 600 599 603 605
|
|
1650 19 602 601 618 620
|
|
1651 20 602 601 618 619
|
|
1652 21 599 601 618 620
|
|
1653 22 599 601 618 619
|
|
1654 113 599 603 606 607
|
|
1655 113 599 603 606 609
|
|
1656 114 604 603 606 607
|
|
1657 114 604 603 606 609
|
|
1658 114 605 603 606 607
|
|
1659 114 605 603 606 609
|
|
1660 115 609 606 607 611
|
|
1661 116 608 607 606 609
|
|
1662 117 603 606 607 611
|
|
1663 118 608 607 606 603
|
|
1664 115 607 606 609 613
|
|
1665 116 610 609 606 607
|
|
1666 117 603 606 609 613
|
|
1667 118 610 609 606 603
|
|
1668 115 606 607 611 615
|
|
1669 116 612 611 607 606
|
|
1670 116 608 607 611 615
|
|
1671 119 608 607 611 612
|
|
1672 115 606 609 613 615
|
|
1673 116 614 613 609 606
|
|
1674 116 610 609 613 615
|
|
1675 119 610 609 613 614
|
|
1676 144 616 615 611 607
|
|
1677 115 607 611 615 613
|
|
1678 145 612 611 615 616
|
|
1679 116 612 611 615 613
|
|
1680 144 616 615 613 609
|
|
1681 115 609 613 615 611
|
|
1682 145 614 613 615 616
|
|
1683 116 614 613 615 611
|
|
1684 146 617 616 615 613
|
|
1685 146 617 616 615 611
|
|
1686 29 622 620 618 601
|
|
1687 89 624 620 618 601
|
|
1688 31 621 620 618 601
|
|
1689 32 622 620 618 619
|
|
1690 90 624 620 618 619
|
|
1691 34 621 620 618 619
|
|
1692 91 624 620 622 623
|
|
1693 92 624 620 622 628
|
|
1694 35 618 620 622 623
|
|
1695 36 618 620 622 628
|
|
1696 8 621 620 622 623
|
|
1697 9 621 620 622 628
|
|
1698 93 622 620 624 625
|
|
1699 93 622 620 624 626
|
|
1700 93 622 620 624 627
|
|
1701 94 618 620 624 625
|
|
1702 94 618 620 624 626
|
|
1703 94 618 620 624 627
|
|
1704 95 621 620 624 625
|
|
1705 95 621 620 624 626
|
|
1706 95 621 620 624 627
|
|
1707 19 623 622 628 630
|
|
1708 20 623 622 628 629
|
|
1709 21 620 622 628 630
|
|
1710 22 620 622 628 629
|
|
1711 148 632 630 628 622
|
|
1712 40 635 630 628 622
|
|
1713 31 631 630 628 622
|
|
1714 149 632 630 628 629
|
|
1715 41 635 630 628 629
|
|
1716 34 631 630 628 629
|
|
1717 150 635 630 632 633
|
|
1718 150 635 630 632 634
|
|
1719 151 628 630 632 633
|
|
1720 151 628 630 632 634
|
|
1721 152 631 630 632 633
|
|
1722 152 631 630 632 634
|
|
1723 153 632 630 635 638
|
|
1724 154 632 630 635 636
|
|
1725 154 632 630 635 637
|
|
1726 102 628 630 635 638
|
|
1727 47 628 630 635 636
|
|
1728 47 628 630 635 637
|
|
1729 103 631 630 635 638
|
|
1730 49 631 630 635 636
|
|
1731 49 631 630 635 637
|
|
1732 104 639 638 635 630
|
|
1733 105 640 638 635 630
|
|
1734 106 639 638 635 636
|
|
1735 107 640 638 635 636
|
|
1736 106 639 638 635 637
|
|
1737 107 640 638 635 637
|
|
1738 108 639 638 640 641
|
|
1739 108 639 638 640 642
|
|
1740 109 635 638 640 641
|
|
1741 109 635 638 640 642
|
|
|
|
Impropers
|
|
|
|
1 1 5 7 17 8
|
|
2 2 7 17 19 18
|
|
3 1 19 21 31 22
|
|
4 2 21 31 33 32
|
|
5 1 33 35 41 36
|
|
6 2 35 41 43 42
|
|
7 1 43 45 51 46
|
|
8 3 45 51 52 54
|
|
9 1 52 57 65 58
|
|
10 2 57 65 67 66
|
|
11 1 67 69 76 70
|
|
12 2 69 76 78 77
|
|
13 1 78 80 95 81
|
|
14 2 80 95 97 96
|
|
15 1 97 99 111 100
|
|
16 2 99 111 113 112
|
|
17 1 113 115 121 116
|
|
18 2 115 121 123 122
|
|
19 1 123 125 144 126
|
|
20 4 136 137 141 138
|
|
21 5 139 138 137 140
|
|
22 5 142 141 137 143
|
|
23 2 125 144 146 145
|
|
24 1 146 148 155 149
|
|
25 2 148 155 157 156
|
|
26 1 157 159 169 160
|
|
27 6 161 164 166 165
|
|
28 7 167 166 164 168
|
|
29 2 159 169 171 170
|
|
30 1 171 173 189 174
|
|
31 8 175 178 181 179
|
|
32 9 180 179 178 183
|
|
33 9 182 181 185 178
|
|
34 9 184 183 179 187
|
|
35 9 186 185 187 181
|
|
36 9 188 187 183 185
|
|
37 2 173 189 191 190
|
|
38 1 191 193 203 194
|
|
39 6 195 198 200 199
|
|
40 7 201 200 198 202
|
|
41 2 193 203 205 204
|
|
42 1 205 207 219 208
|
|
43 2 207 219 221 220
|
|
44 1 221 223 229 224
|
|
45 2 223 229 231 230
|
|
46 1 231 233 252 234
|
|
47 4 244 245 249 246
|
|
48 5 247 246 245 248
|
|
49 5 250 249 245 251
|
|
50 2 233 252 254 253
|
|
51 1 254 256 271 257
|
|
52 3 256 271 272 274
|
|
53 1 272 277 285 278
|
|
54 10 277 285 287 286
|
|
55 11 287 290 292 291
|
|
56 2 290 292 294 293
|
|
57 1 294 296 306 297
|
|
58 3 296 306 307 309
|
|
59 1 307 312 320 313
|
|
60 2 312 320 322 321
|
|
61 1 322 324 336 325
|
|
62 12 329 332 333 334
|
|
63 2 324 336 338 337
|
|
64 1 338 340 346 341
|
|
65 2 340 346 348 347
|
|
66 1 348 350 365 351
|
|
67 2 350 365 367 366
|
|
68 1 367 369 375 370
|
|
69 2 369 375 377 376
|
|
70 1 377 379 385 380
|
|
71 2 379 385 387 386
|
|
72 1 387 389 399 390
|
|
73 2 389 399 401 400
|
|
74 1 401 403 420 404
|
|
75 8 405 408 411 409
|
|
76 9 410 409 408 413
|
|
77 9 412 411 415 408
|
|
78 9 414 413 409 417
|
|
79 9 416 415 417 411
|
|
80 13 418 417 415 413
|
|
81 2 403 420 422 421
|
|
82 1 422 424 434 425
|
|
83 10 424 434 436 435
|
|
84 11 436 439 441 440
|
|
85 2 439 441 443 442
|
|
86 1 443 445 451 446
|
|
87 2 445 451 453 452
|
|
88 1 453 455 470 456
|
|
89 2 455 470 472 471
|
|
90 1 472 474 489 475
|
|
91 2 474 489 491 490
|
|
92 1 491 493 508 494
|
|
93 3 493 508 509 511
|
|
94 1 509 514 522 515
|
|
95 10 514 522 524 523
|
|
96 11 524 527 529 528
|
|
97 2 527 529 531 530
|
|
98 1 531 533 539 534
|
|
99 2 533 539 541 540
|
|
100 1 541 543 553 544
|
|
101 2 543 553 555 554
|
|
102 1 555 557 563 558
|
|
103 3 557 563 564 566
|
|
104 1 564 569 577 570
|
|
105 10 569 577 579 578
|
|
106 11 579 582 584 583
|
|
107 2 582 584 586 585
|
|
108 1 586 588 597 589
|
|
109 12 590 593 594 595
|
|
110 2 588 597 599 598
|
|
111 1 599 601 618 602
|
|
112 8 603 606 609 607
|
|
113 9 608 607 606 611
|
|
114 9 610 609 613 606
|
|
115 9 612 611 607 615
|
|
116 9 614 613 615 609
|
|
117 13 616 615 613 611
|
|
118 2 601 618 620 619
|
|
119 1 620 622 628 623
|
|
120 2 622 628 630 629
|
|
121 14 630 632 634 633
|
|
122 6 635 638 640 639
|
|
123 7 641 640 638 642
|
|
|