LAMMPS data file. msi2lmp v3.9.7 / 24 Oct 2015 / CGCMM for pmma-poly-class2c 152 atoms 151 bonds 280 angles 371 dihedrals 170 impropers 8 atom types 12 bond types 26 angle types 35 dihedral types 19 improper types -3.031181000 16.410415000 xlo xhi -14.383047000 6.110202000 ylo yhi -11.174386000 3.653585000 zlo zhi Masses 1 12.011150 # c 2 12.011150 # c3 3 12.011150 # c_1 4 15.999400 # o_2 5 1.007970 # hc 6 15.999400 # o_1 7 12.011150 # c2 8 12.011150 # c1 Pair Coeffs # lj/class2/coul/long 1 0.0540000000 4.0100000000 # c 2 0.0540000000 4.0100000000 # c3 3 0.1200000000 3.8100000000 # c_1 4 0.2400000000 3.4200000000 # o_2 5 0.0200000000 2.9950000000 # hc 6 0.2670000000 3.3000000000 # o_1 7 0.0540000000 4.0100000000 # c2 8 0.0540000000 4.0100000000 # c1 Bond Coeffs # class2 1 1.5202 253.7067 -423.0370 396.9000 # c-c_1 2 1.5300 299.6700 -501.7700 679.8100 # c-c3 3 1.5300 299.6700 -501.7700 679.8100 # c-c2 4 1.1010 345.0000 -691.8900 844.6000 # c3-hc 5 1.3683 367.1481 -794.7908 1055.2319 # c_1-o_2 6 1.2020 851.1403 -1918.4882 2160.7659 # c_1-o_1 7 1.4300 326.7273 -608.5306 689.0333 # c3-o_2 8 1.1010 345.0000 -691.8900 844.6000 # hc-c2 9 1.1010 345.0000 -691.8900 844.6000 # hc-c1 10 1.5202 253.7067 -423.0370 396.9000 # c_1-c1 11 1.5300 299.6700 -501.7700 679.8100 # c2-c1 12 1.5300 299.6700 -501.7700 679.8100 # c3-c1 Angle Coeffs # class2 1 108.5295 51.9747 -9.4851 -10.9985 # c3-c-c_1 2 108.5295 51.9747 -9.4851 -10.9985 # c_1-c-c2 3 112.6700 39.5160 -7.4430 -9.5583 # c3-c-c3 4 112.6700 39.5160 -7.4430 -9.5583 # c3-c-c2 5 107.6600 39.6410 -12.9210 -2.4318 # hc-c3-hc 6 110.7700 41.4530 -10.6040 5.1290 # c-c3-hc 7 100.3182 38.8631 -3.8323 -7.9802 # c-c_1-o_2 8 123.1451 55.5431 -17.2123 0.1348 # c-c_1-o_1 9 120.7970 95.3446 -32.2869 6.3778 # o_2-c_1-o_1 10 113.2880 61.2868 -28.9786 7.9929 # c3-o_2-c_1 11 107.6880 65.4801 -10.3498 5.8866 # o_2-c3-hc 12 112.6700 39.5160 -7.4430 -9.5583 # c2-c-c2 13 107.6600 39.6410 -12.9210 -2.4318 # hc-c2-hc 14 110.7700 41.4530 -10.6040 5.1290 # c-c2-hc 15 112.6700 39.5160 -7.4430 -9.5583 # c-c2-c 16 107.7336 40.6099 -28.8121 0.0000 # c_1-c1-hc 17 110.7700 41.4530 -10.6040 5.1290 # hc-c1-c2 18 110.7700 41.4530 -10.6040 5.1290 # c3-c1-hc 19 108.5295 51.9747 -9.4851 -10.9985 # c_1-c1-c2 20 108.5295 51.9747 -9.4851 -10.9985 # c3-c1-c_1 21 112.6700 39.5160 -7.4430 -9.5583 # c3-c1-c2 22 110.7700 41.4530 -10.6040 5.1290 # hc-c2-c1 23 112.6700 39.5160 -7.4430 -9.5583 # c-c2-c1 24 100.3182 38.8631 -3.8323 -7.9802 # o_2-c_1-c1 25 123.1451 55.5431 -17.2123 0.1348 # o_1-c_1-c1 26 110.7700 41.4530 -10.6040 5.1290 # hc-c3-c1 Dihedral Coeffs # class2 1 1.8341 0.0000 2.0603 0.0000 -0.0195 0.0000# c3-c-c_1-o_2 2 0.0442 0.0000 0.0292 0.0000 0.0562 0.0000# c3-c-c_1-o_1 3 1.8341 0.0000 2.0603 0.0000 -0.0195 0.0000# c2-c-c_1-o_2 4 0.0442 0.0000 0.0292 0.0000 0.0562 0.0000# c2-c-c_1-o_1 5 -0.0228 0.0000 0.0280 0.0000 -0.1863 0.0000# c_1-c-c3-hc 6 0.0000 0.0000 0.0316 0.0000 -0.1681 0.0000# c3-c-c3-hc 7 0.0000 0.0000 0.0316 0.0000 -0.1681 0.0000# c2-c-c3-hc 8 -0.0228 0.0000 0.0280 0.0000 -0.1863 0.0000# c_1-c-c2-hc 9 0.0972 0.0000 0.0722 0.0000 -0.2581 0.0000# c_1-c-c2-c 10 0.0000 0.0000 0.0316 0.0000 -0.1681 0.0000# c3-c-c2-hc 11 0.0000 0.0000 0.0514 0.0000 -0.1430 0.0000# c3-c-c2-c 12 -2.5594 0.0000 2.2013 0.0000 0.0325 0.0000# c-c_1-o_2-c3 13 -2.5594 0.0000 2.2013 0.0000 0.0325 0.0000# o_1-c_1-o_2-c3 14 0.0000 0.0000 0.0000 0.0000 -0.1932 0.0000# hc-c3-o_2-c_1 15 0.0000 0.0000 0.0316 0.0000 -0.1681 0.0000# c2-c-c2-hc 16 0.0000 0.0000 0.0514 0.0000 -0.1430 0.0000# c2-c-c2-c 17 0.0972 0.0000 0.0722 0.0000 -0.2581 0.0000# c_1-c-c2-c1 18 0.0000 0.0000 0.0514 0.0000 -0.1430 0.0000# c2-c-c2-c1 19 0.0000 0.0000 0.0514 0.0000 -0.1430 0.0000# c3-c-c2-c1 20 -0.6359 0.0000 1.4807 0.0000 -0.0438 0.0000# o_2-c_1-c1-hc 21 -0.1804 0.0000 0.0012 0.0000 0.0371 0.0000# o_1-c_1-c1-hc 22 1.8341 0.0000 2.0603 0.0000 -0.0195 0.0000# o_2-c_1-c1-c2 23 0.0442 0.0000 0.0292 0.0000 0.0562 0.0000# o_1-c_1-c1-c2 24 1.8341 0.0000 2.0603 0.0000 -0.0195 0.0000# o_2-c_1-c1-c3 25 0.0442 0.0000 0.0292 0.0000 0.0562 0.0000# o_1-c_1-c1-c3 26 -0.1432 0.0000 0.0617 0.0000 -0.1083 0.0000# hc-c2-c1-hc 27 0.0000 0.0000 0.0316 0.0000 -0.1681 0.0000# c-c2-c1-hc 28 -0.0228 0.0000 0.0280 0.0000 -0.1863 0.0000# hc-c2-c1-c_1 29 0.0972 0.0000 0.0722 0.0000 -0.2581 0.0000# c-c2-c1-c_1 30 0.0000 0.0000 0.0316 0.0000 -0.1681 0.0000# hc-c2-c1-c3 31 0.0000 0.0000 0.0514 0.0000 -0.1430 0.0000# c-c2-c1-c3 32 -0.1432 0.0000 0.0617 0.0000 -0.1083 0.0000# hc-c3-c1-hc 33 -0.0228 0.0000 0.0280 0.0000 -0.1863 0.0000# hc-c3-c1-c_1 34 0.0000 0.0000 0.0316 0.0000 -0.1681 0.0000# hc-c3-c1-c2 35 -2.5594 0.0000 2.2013 0.0000 0.0325 0.0000# c1-c_1-o_2-c3 Improper Coeffs # class2 1 46.9264 0.0000 # c-c_1-o_2-o_1 2 46.9264 0.0000 # o_2-c_1-o_1-c1 3 0.0000 0.0000 4 0.0000 0.0000 5 0.0000 0.0000 6 0.0000 0.0000 7 0.0000 0.0000 8 0.0000 0.0000 9 0.0000 0.0000 10 0.0000 0.0000 11 0.0000 0.0000 12 0.0000 0.0000 13 0.0000 0.0000 14 0.0000 0.0000 15 0.0000 0.0000 16 0.0000 0.0000 17 0.0000 0.0000 18 0.0000 0.0000 19 0.0000 0.0000 BondBond Coeffs 1 5.4199 1.5300 1.5202 2 5.4199 1.5202 1.5300 3 0.0000 1.5300 1.5300 4 0.0000 1.5300 1.5300 5 5.3316 1.1010 1.1010 6 3.3872 1.5300 1.1010 7 19.1069 1.5202 1.3683 8 46.0685 1.5202 1.2020 9 121.4880 1.3683 1.2020 10 45.4503 1.4300 1.3683 11 5.6454 1.4300 1.1010 12 0.0000 1.5300 1.5300 13 5.3316 1.1010 1.1010 14 3.3872 1.5300 1.1010 15 0.0000 1.5300 1.5300 16 0.7115 1.5202 1.1010 17 3.3872 1.1010 1.5300 18 3.3872 1.5300 1.1010 19 5.4199 1.5202 1.5300 20 5.4199 1.5300 1.5202 21 0.0000 1.5300 1.5300 22 3.3872 1.1010 1.5300 23 0.0000 1.5300 1.5300 24 19.1069 1.3683 1.5202 25 46.0685 1.2020 1.5202 26 3.3872 1.1010 1.5300 BondAngle Coeffs 1 18.1678 15.8758 1.5300 1.5202 2 15.8758 18.1678 1.5202 1.5300 3 8.0160 8.0160 1.5300 1.5300 4 8.0160 8.0160 1.5300 1.5300 5 18.1030 18.1030 1.1010 1.1010 6 20.7540 11.4210 1.5300 1.1010 7 1.3435 4.6978 1.5202 1.3683 8 34.9982 37.1298 1.5202 1.2020 9 71.8761 76.2614 1.3683 1.2020 10 41.9116 46.4608 1.4300 1.3683 11 57.4975 8.6864 1.4300 1.1010 12 8.0160 8.0160 1.5300 1.5300 13 18.1030 18.1030 1.1010 1.1010 14 20.7540 11.4210 1.5300 1.1010 15 8.0160 8.0160 1.5300 1.5300 16 12.4632 9.1765 1.5202 1.1010 17 11.4210 20.7540 1.1010 1.5300 18 20.7540 11.4210 1.5300 1.1010 19 15.8758 18.1678 1.5202 1.5300 20 18.1678 15.8758 1.5300 1.5202 21 8.0160 8.0160 1.5300 1.5300 22 11.4210 20.7540 1.1010 1.5300 23 8.0160 8.0160 1.5300 1.5300 24 4.6978 1.3435 1.3683 1.5202 25 37.1298 34.9982 1.2020 1.5202 26 11.4210 20.7540 1.1010 1.5300 AngleAngle Coeffs 1 0.0000 0.0000 0.0000 100.3182 120.7970 123.1451 2 0.0000 0.0000 0.0000 120.7970 123.1451 100.3182 3 0.0000 0.0000 0.0000 112.6700 108.5295 108.5295 4 0.0000 0.0000 0.0000 108.5295 108.5295 112.6700 5 -0.1729 -0.1729 -0.1729 112.6700 112.6700 112.6700 6 -0.3157 -0.3157 -0.3157 107.6600 107.6600 107.6600 7 0.2738 -0.4825 0.2738 110.7700 107.6600 110.7700 8 0.0000 0.0000 0.0000 107.6880 107.6600 107.6880 9 0.0000 0.0000 0.0000 108.5295 112.6700 108.5295 10 -0.1729 -0.1729 -0.1729 112.6700 112.6700 112.6700 11 0.2738 -0.4825 0.2738 110.7700 107.6600 110.7700 12 -1.3199 -1.3199 0.1184 112.6700 110.7700 110.7700 13 1.0827 2.0403 -1.8202 107.7336 110.7700 108.5295 14 2.0403 -1.8202 1.0827 108.5295 107.7336 110.7700 15 0.1184 -1.3199 -1.3199 110.7700 110.7700 112.6700 16 0.0000 0.0000 0.0000 108.5295 108.5295 112.6700 17 0.2738 0.2738 -0.4825 107.6600 110.7700 110.7700 18 0.1184 -1.3199 -1.3199 110.7700 110.7700 112.6700 19 0.2738 0.2738 -0.4825 107.6600 110.7700 110.7700 AngleAngleTorsion Coeffs 1 0.0000 108.5295 100.3182 2 -8.0190 108.5295 123.1451 3 0.0000 108.5295 100.3182 4 -8.0190 108.5295 123.1451 5 -5.3624 108.5295 110.7700 6 -16.1640 112.6700 110.7700 7 -16.1640 112.6700 110.7700 8 -5.3624 108.5295 110.7700 9 -0.3801 108.5295 112.6700 10 -16.1640 112.6700 110.7700 11 -22.0450 112.6700 112.6700 12 0.0000 100.3182 113.2880 13 0.0000 120.7970 113.2880 14 0.0000 107.6880 113.2880 15 -16.1640 112.6700 110.7700 16 -22.0450 112.6700 112.6700 17 -0.3801 108.5295 112.6700 18 -22.0450 112.6700 112.6700 19 -22.0450 112.6700 112.6700 20 0.0000 100.3182 107.7336 21 -15.3496 123.1451 107.7336 22 0.0000 100.3182 108.5295 23 -8.0190 123.1451 108.5295 24 0.0000 100.3182 108.5295 25 -8.0190 123.1451 108.5295 26 -12.5640 110.7700 110.7700 27 -16.1640 112.6700 110.7700 28 -5.3624 110.7700 108.5295 29 -0.3801 112.6700 108.5295 30 -16.1640 110.7700 112.6700 31 -22.0450 112.6700 112.6700 32 -12.5640 110.7700 110.7700 33 -5.3624 110.7700 108.5295 34 -16.1640 110.7700 112.6700 35 0.0000 100.3182 113.2880 EndBondTorsion Coeffs 1 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.5300 1.3683 2 0.2654 0.0503 0.1046 -0.2810 0.0816 -0.1522 1.5300 1.2020 3 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.5300 1.3683 4 0.2654 0.0503 0.1046 -0.2810 0.0816 -0.1522 1.5300 1.2020 5 -0.0204 0.3628 -0.4426 -0.0097 -0.0315 -0.0755 1.5202 1.1010 6 0.2486 0.2422 -0.0925 0.0814 0.0591 0.2219 1.5300 1.1010 7 0.2486 0.2422 -0.0925 0.0814 0.0591 0.2219 1.5300 1.1010 8 -0.0204 0.3628 -0.4426 -0.0097 -0.0315 -0.0755 1.5202 1.1010 9 0.0055 0.0060 -0.0009 0.0062 -0.0002 0.0036 1.5202 1.5300 10 0.2486 0.2422 -0.0925 0.0814 0.0591 0.2219 1.5300 1.1010 11 -0.0732 0.0000 0.0000 -0.0732 0.0000 0.0000 1.5300 1.5300 12 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.5202 1.4300 13 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.2020 1.4300 14 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.1010 1.3683 15 0.2486 0.2422 -0.0925 0.0814 0.0591 0.2219 1.5300 1.1010 16 -0.0732 0.0000 0.0000 -0.0732 0.0000 0.0000 1.5300 1.5300 17 0.0055 0.0060 -0.0009 0.0062 -0.0002 0.0036 1.5202 1.5300 18 -0.0732 0.0000 0.0000 -0.0732 0.0000 0.0000 1.5300 1.5300 19 -0.0732 0.0000 0.0000 -0.0732 0.0000 0.0000 1.5300 1.5300 20 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.3683 1.1010 21 -0.2298 0.0354 0.3853 1.2143 0.2831 0.3916 1.2020 1.1010 22 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.3683 1.5300 23 -0.2810 0.0816 -0.1522 0.2654 0.0503 0.1046 1.2020 1.5300 24 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.3683 1.5300 25 -0.2810 0.0816 -0.1522 0.2654 0.0503 0.1046 1.2020 1.5300 26 0.2130 0.3120 0.0777 0.2130 0.3120 0.0777 1.1010 1.1010 27 0.2486 0.2422 -0.0925 0.0814 0.0591 0.2219 1.5300 1.1010 28 -0.0097 -0.0315 -0.0755 -0.0204 0.3628 -0.4426 1.1010 1.5202 29 0.0062 -0.0002 0.0036 0.0055 0.0060 -0.0009 1.5300 1.5202 30 0.0814 0.0591 0.2219 0.2486 0.2422 -0.0925 1.1010 1.5300 31 -0.0732 0.0000 0.0000 -0.0732 0.0000 0.0000 1.5300 1.5300 32 0.2130 0.3120 0.0777 0.2130 0.3120 0.0777 1.1010 1.1010 33 -0.0097 -0.0315 -0.0755 -0.0204 0.3628 -0.4426 1.1010 1.5202 34 0.0814 0.0591 0.2219 0.2486 0.2422 -0.0925 1.1010 1.5300 35 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.5202 1.4300 MiddleBondTorsion Coeffs 1 -17.3280 -5.7900 -3.2114 1.5202 2 0.3388 -0.1096 0.1219 1.5202 3 -17.3280 -5.7900 -3.2114 1.5202 4 0.3388 -0.1096 0.1219 1.5202 5 -3.5039 1.2458 -0.7610 1.5300 6 -14.8790 -3.6581 -0.3138 1.5300 7 -14.8790 -3.6581 -0.3138 1.5300 8 -3.5039 1.2458 -0.7610 1.5300 9 -1.5945 0.2267 -0.6911 1.5300 10 -14.8790 -3.6581 -0.3138 1.5300 11 -17.7870 -7.1877 0.0000 1.5300 12 1.3445 3.5515 -4.9202 1.3683 13 4.2600 0.0000 0.0000 1.3683 14 0.0000 0.0000 0.0000 1.4300 15 -14.8790 -3.6581 -0.3138 1.5300 16 -17.7870 -7.1877 0.0000 1.5300 17 -1.5945 0.2267 -0.6911 1.5300 18 -17.7870 -7.1877 0.0000 1.5300 19 -17.7870 -7.1877 0.0000 1.5300 20 -13.7686 -2.5959 1.1934 1.5202 21 0.2359 0.9139 0.9594 1.5202 22 -17.3280 -5.7900 -3.2114 1.5202 23 0.3388 -0.1096 0.1219 1.5202 24 -17.3280 -5.7900 -3.2114 1.5202 25 0.3388 -0.1096 0.1219 1.5202 26 -14.2610 -0.5322 -0.4864 1.5300 27 -14.8790 -3.6581 -0.3138 1.5300 28 -3.5039 1.2458 -0.7610 1.5300 29 -1.5945 0.2267 -0.6911 1.5300 30 -14.8790 -3.6581 -0.3138 1.5300 31 -17.7870 -7.1877 0.0000 1.5300 32 -14.2610 -0.5322 -0.4864 1.5300 33 -3.5039 1.2458 -0.7610 1.5300 34 -14.8790 -3.6581 -0.3138 1.5300 35 1.3445 3.5515 -4.9202 1.3683 BondBond13 Coeffs 1 0.0000 1.5300 1.3683 2 0.0000 1.5300 1.2020 3 0.0000 1.5300 1.3683 4 0.0000 1.5300 1.2020 5 0.0000 1.5202 1.1010 6 0.0000 1.5300 1.1010 7 0.0000 1.5300 1.1010 8 0.0000 1.5202 1.1010 9 0.0000 1.5202 1.5300 10 0.0000 1.5300 1.1010 11 0.0000 1.5300 1.5300 12 0.0000 1.5202 1.4300 13 0.0000 1.2020 1.4300 14 0.0000 1.1010 1.3683 15 0.0000 1.5300 1.1010 16 0.0000 1.5300 1.5300 17 0.0000 1.5202 1.5300 18 0.0000 1.5300 1.5300 19 0.0000 1.5300 1.5300 20 0.0000 1.3683 1.1010 21 0.0000 1.2020 1.1010 22 0.0000 1.3683 1.5300 23 0.0000 1.2020 1.5300 24 0.0000 1.3683 1.5300 25 0.0000 1.2020 1.5300 26 0.0000 1.1010 1.1010 27 0.0000 1.5300 1.1010 28 0.0000 1.1010 1.5202 29 0.0000 1.5300 1.5202 30 0.0000 1.1010 1.5300 31 0.0000 1.5300 1.5300 32 0.0000 1.1010 1.1010 33 0.0000 1.1010 1.5202 34 0.0000 1.1010 1.5300 35 0.0000 1.5202 1.4300 AngleTorsion Coeffs 1 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 108.5295 100.3182 2 0.0885 -1.3703 -0.5452 0.6750 0.5965 0.6725 108.5295 123.1451 3 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 108.5295 100.3182 4 0.0885 -1.3703 -0.5452 0.6750 0.5965 0.6725 108.5295 123.1451 5 -0.7466 -0.9448 -0.6321 0.0162 1.4211 -1.4092 108.5295 110.7700 6 -0.2454 0.0000 -0.1136 0.3113 0.4516 -0.1988 112.6700 110.7700 7 -0.2454 0.0000 -0.1136 0.3113 0.4516 -0.1988 112.6700 110.7700 8 -0.7466 -0.9448 -0.6321 0.0162 1.4211 -1.4092 108.5295 110.7700 9 0.0515 -0.0674 -0.0474 -0.2607 0.3203 -0.2283 108.5295 112.6700 10 -0.2454 0.0000 -0.1136 0.3113 0.4516 -0.1988 112.6700 110.7700 11 0.3886 -0.3139 0.1389 0.3886 -0.3139 0.1389 112.6700 112.6700 12 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 100.3182 113.2880 13 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 120.7970 113.2880 14 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 107.6880 113.2880 15 -0.2454 0.0000 -0.1136 0.3113 0.4516 -0.1988 112.6700 110.7700 16 0.3886 -0.3139 0.1389 0.3886 -0.3139 0.1389 112.6700 112.6700 17 0.0515 -0.0674 -0.0474 -0.2607 0.3203 -0.2283 108.5295 112.6700 18 0.3886 -0.3139 0.1389 0.3886 -0.3139 0.1389 112.6700 112.6700 19 0.3886 -0.3139 0.1389 0.3886 -0.3139 0.1389 112.6700 112.6700 20 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 100.3182 107.7336 21 -1.4946 0.7308 -0.2083 9.1299 -0.4847 0.3582 123.1451 107.7336 22 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 100.3182 108.5295 23 0.6750 0.5965 0.6725 0.0885 -1.3703 -0.5452 123.1451 108.5295 24 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 100.3182 108.5295 25 0.6750 0.5965 0.6725 0.0885 -1.3703 -0.5452 123.1451 108.5295 26 -0.8085 0.5569 -0.2466 -0.8085 0.5569 -0.2466 110.7700 110.7700 27 -0.2454 0.0000 -0.1136 0.3113 0.4516 -0.1988 112.6700 110.7700 28 0.0162 1.4211 -1.4092 -0.7466 -0.9448 -0.6321 110.7700 108.5295 29 -0.2607 0.3203 -0.2283 0.0515 -0.0674 -0.0474 112.6700 108.5295 30 0.3113 0.4516 -0.1988 -0.2454 0.0000 -0.1136 110.7700 112.6700 31 0.3886 -0.3139 0.1389 0.3886 -0.3139 0.1389 112.6700 112.6700 32 -0.8085 0.5569 -0.2466 -0.8085 0.5569 -0.2466 110.7700 110.7700 33 0.0162 1.4211 -1.4092 -0.7466 -0.9448 -0.6321 110.7700 108.5295 34 0.3113 0.4516 -0.1988 -0.2454 0.0000 -0.1136 110.7700 112.6700 35 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 100.3182 113.2880 Atoms # full 1 1 1 0.000000 -0.633418000 3.634698000 -0.520447000 0 0 0 # c 2 1 2 -0.159000 -1.681078000 4.738564000 -0.675925000 0 0 0 # c3 3 1 3 0.266000 -1.387493000 2.511538000 0.201451000 0 0 0 # c_1 4 1 4 -0.266000 -0.833117000 2.333802000 1.415262000 0 0 0 # o_2 5 1 2 -0.026000 -1.417542000 1.295223000 2.194265000 0 0 0 # c3 6 1 5 0.053000 -2.476360000 1.527665000 2.374308000 0 0 0 # hc 7 1 5 0.053000 -2.531181000 4.392408000 -1.284049000 0 0 0 # hc 8 1 5 0.053000 -0.886560000 1.228488000 3.153585000 0 0 0 # hc 9 1 5 0.053000 -1.228588000 5.610202000 -1.173631000 0 0 0 # hc 10 1 5 0.053000 -2.070284000 5.062610000 0.301509000 0 0 0 # hc 11 1 5 0.053000 -1.325591000 0.341689000 1.655498000 0 0 0 # hc 12 1 2 -0.159000 0.512831000 4.150735000 0.351569000 0 0 0 # c3 13 1 5 0.053000 1.055972000 4.940079000 -0.192088000 0 0 0 # hc 14 1 5 0.053000 1.238964000 3.371721000 0.627844000 0 0 0 # hc 15 1 5 0.053000 0.117814000 4.600272000 1.276936000 0 0 0 # hc 16 1 6 -0.133000 -2.322596000 1.880616000 -0.204263000 0 0 0 # o_1 17 2 1 0.000000 0.804693000 2.145964000 -2.336744000 0 0 0 # c 18 2 7 -0.106000 -0.294421000 3.170838000 -1.953678000 0 0 0 # c2 19 2 3 0.266000 2.138571000 2.832879000 -2.103460000 0 0 0 # c_1 20 2 4 -0.266000 2.372145000 3.671394000 -3.131947000 0 0 0 # o_2 21 2 2 -0.026000 3.602748000 4.383361000 -3.054350000 0 0 0 # c3 22 2 5 0.053000 3.610506000 4.998838000 -2.143924000 0 0 0 # hc 23 2 5 0.053000 3.694800000 5.030836000 -3.937109000 0 0 0 # hc 24 2 5 0.053000 -1.235915000 2.773341000 -2.374311000 0 0 0 # hc 25 2 5 0.053000 -0.081285000 4.091302000 -2.526023000 0 0 0 # hc 26 2 5 0.053000 4.436044000 3.667105000 -3.035015000 0 0 0 # hc 27 2 2 -0.159000 0.611666000 1.991584000 -3.851496000 0 0 0 # c3 28 2 5 0.053000 -0.289273000 1.387825000 -4.043900000 0 0 0 # hc 29 2 5 0.053000 1.463121000 1.506181000 -4.351096000 0 0 0 # hc 30 2 5 0.053000 0.447238000 2.968089000 -4.333583000 0 0 0 # hc 31 2 6 -0.133000 2.890594000 2.696257000 -1.179564000 0 0 0 # o_1 32 3 1 0.000000 1.397177000 -0.496953000 -1.800162000 0 0 0 # c 33 3 7 -0.106000 0.691539000 0.852868000 -1.495129000 0 0 0 # c2 34 3 3 0.266000 0.695638000 -1.078791000 -3.017470000 0 0 0 # c_1 35 3 4 -0.266000 -0.433002000 -1.685271000 -2.599657000 0 0 0 # o_2 36 3 2 -0.026000 -1.200644000 -2.295669000 -3.631502000 0 0 0 # c3 37 3 5 0.053000 -1.507749000 -1.530598000 -4.358027000 0 0 0 # hc 38 3 5 0.053000 -2.091554000 -2.757962000 -3.184979000 0 0 0 # hc 39 3 5 0.053000 0.980971000 1.115979000 -0.462722000 0 0 0 # hc 40 3 5 0.053000 -0.384900000 0.614574000 -1.458910000 0 0 0 # hc 41 3 5 0.053000 -0.594468000 -3.067094000 -4.126610000 0 0 0 # hc 42 3 2 -0.159000 1.017164000 -1.351769000 -0.581861000 0 0 0 # c3 43 3 5 0.053000 1.624485000 -1.039640000 0.282512000 0 0 0 # hc 44 3 5 0.053000 1.174800000 -2.428888000 -0.737066000 0 0 0 # hc 45 3 5 0.053000 -0.036762000 -1.199383000 -0.300261000 0 0 0 # hc 46 3 6 -0.133000 1.027390000 -1.028862000 -4.168218000 0 0 0 # o_1 47 4 1 0.000000 3.966949000 -1.439368000 -2.191285000 0 0 0 # c 48 4 7 -0.106000 2.913413000 -0.313606000 -2.028563000 0 0 0 # c2 49 4 3 0.266000 3.989592000 -2.240375000 -0.907672000 0 0 0 # c_1 50 4 4 -0.266000 4.599493000 -1.508560000 0.045550000 0 0 0 # o_2 51 4 2 -0.026000 4.686298000 -2.139943000 1.318815000 0 0 0 # c3 52 4 5 0.053000 3.673589000 -2.349798000 1.690021000 0 0 0 # hc 53 4 5 0.053000 5.200688000 -1.464754000 2.016189000 0 0 0 # hc 54 4 5 0.053000 3.037439000 0.331225000 -2.915449000 0 0 0 # hc 55 4 5 0.053000 3.252029000 0.280214000 -1.163342000 0 0 0 # hc 56 4 5 0.053000 5.255838000 -3.074913000 1.223300000 0 0 0 # hc 57 4 2 -0.159000 5.282529000 -0.651603000 -2.269945000 0 0 0 # c3 58 4 5 0.053000 5.346025000 -0.148371000 -3.247479000 0 0 0 # hc 59 4 5 0.053000 6.171959000 -1.287625000 -2.151011000 0 0 0 # hc 60 4 5 0.053000 5.331038000 0.138310000 -1.504257000 0 0 0 # hc 61 4 6 -0.133000 3.545053000 -3.337606000 -0.715715000 0 0 0 # o_1 62 5 1 0.000000 4.620833000 -3.326693000 -4.109533000 0 0 0 # c 63 5 7 -0.106000 3.652503000 -2.337506000 -3.407769000 0 0 0 # c2 64 5 3 0.266000 5.653604000 -2.472614000 -4.831647000 0 0 0 # c_1 65 5 4 -0.266000 5.111475000 -2.022075000 -5.980401000 0 0 0 # o_2 66 5 2 -0.026000 5.971771000 -1.203306000 -6.765481000 0 0 0 # c3 67 5 5 0.053000 6.260026000 -0.316003000 -6.184475000 0 0 0 # hc 68 5 5 0.053000 5.435290000 -0.890960000 -7.671954000 0 0 0 # hc 69 5 5 0.053000 2.753672000 -2.924820000 -3.151292000 0 0 0 # hc 70 5 5 0.053000 3.352208000 -1.638604000 -4.206128000 0 0 0 # hc 71 5 5 0.053000 6.864808000 -1.779197000 -7.046079000 0 0 0 # hc 72 5 2 -0.159000 3.708002000 -3.959156000 -5.169887000 0 0 0 # c3 73 5 5 0.053000 3.031714000 -4.679313000 -4.682555000 0 0 0 # hc 74 5 5 0.053000 4.256861000 -4.488719000 -5.962328000 0 0 0 # hc 75 5 5 0.053000 3.068976000 -3.201001000 -5.649870000 0 0 0 # hc 76 5 6 -0.133000 6.768331000 -2.204430000 -4.480250000 0 0 0 # o_1 77 6 1 0.000000 6.093263000 -5.587913000 -3.560636000 0 0 0 # c 78 6 7 -0.106000 5.308751000 -4.312834000 -3.138300000 0 0 0 # c2 79 6 3 0.266000 5.049508000 -6.603485000 -4.003777000 0 0 0 # c_1 80 6 4 -0.266000 4.554427000 -7.203560000 -2.902940000 0 0 0 # o_2 81 6 2 -0.026000 3.562981000 -8.192962000 -3.156902000 0 0 0 # c3 82 6 5 0.053000 2.705493000 -7.727344000 -3.662190000 0 0 0 # hc 83 6 5 0.053000 3.237173000 -8.622824000 -2.199861000 0 0 0 # hc 84 6 5 0.053000 5.995489000 -3.722546000 -2.507421000 0 0 0 # hc 85 6 5 0.053000 4.514555000 -4.679531000 -2.467788000 0 0 0 # hc 86 6 5 0.053000 3.991532000 -8.983665000 -3.788604000 0 0 0 # hc 87 6 2 -0.159000 6.684506000 -6.073042000 -2.229026000 0 0 0 # c3 88 6 5 0.053000 7.545290000 -5.439783000 -1.961956000 0 0 0 # hc 89 6 5 0.053000 7.027618000 -7.117413000 -2.257204000 0 0 0 # hc 90 6 5 0.053000 5.953601000 -5.976673000 -1.410522000 0 0 0 # hc 91 6 6 -0.133000 4.679701000 -6.860981000 -5.114546000 0 0 0 # o_1 92 7 1 0.000000 8.191866000 -6.276687000 -5.226719000 0 0 0 # c 93 7 7 -0.106000 7.125233000 -5.298659000 -4.672132000 0 0 0 # c2 94 7 3 0.266000 9.135855000 -6.617834000 -4.092568000 0 0 0 # c_1 95 7 4 -0.266000 9.934906000 -5.557047000 -3.864645000 0 0 0 # o_2 96 7 2 -0.026000 10.892382000 -5.742399000 -2.827400000 0 0 0 # c3 97 7 5 0.053000 11.553396000 -6.580327000 -3.089232000 0 0 0 # hc 98 7 5 0.053000 10.370519000 -5.952330000 -1.883435000 0 0 0 # hc 99 7 5 0.053000 6.567923000 -4.948063000 -5.557544000 0 0 0 # hc 100 7 5 0.053000 7.696444000 -4.433111000 -4.298730000 0 0 0 # hc 101 7 5 0.053000 11.485685000 -4.823608000 -2.723420000 0 0 0 # hc 102 7 2 -0.159000 8.957459000 -5.391017000 -6.221052000 0 0 0 # c3 103 7 5 0.053000 8.333050000 -5.226114000 -7.113266000 0 0 0 # hc 104 7 5 0.053000 9.910684000 -5.832380000 -6.545212000 0 0 0 # hc 105 7 5 0.053000 9.175643000 -4.397358000 -5.799012000 0 0 0 # hc 106 7 6 -0.133000 9.199344000 -7.640210000 -3.468747000 0 0 0 # o_1 107 8 1 0.000000 8.262760000 -8.564497000 -6.769855000 0 0 0 # c 108 8 7 -0.106000 7.556560000 -7.548515000 -5.830486000 0 0 0 # c2 109 8 3 0.266000 8.456504000 -7.871008000 -8.103271000 0 0 0 # c_1 110 8 4 -0.266000 7.266992000 -7.835138000 -8.736810000 0 0 0 # o_2 111 8 2 -0.026000 7.283962000 -7.192355000 -10.006775000 0 0 0 # c3 112 8 5 0.053000 6.270957000 -7.218684000 -10.431104000 0 0 0 # hc 113 8 5 0.053000 7.976685000 -7.723474000 -10.674386000 0 0 0 # hc 114 8 5 0.053000 7.154862000 -8.142299000 -4.991093000 0 0 0 # hc 115 8 5 0.053000 6.685583000 -7.189461000 -6.402577000 0 0 0 # hc 116 8 5 0.053000 7.603477000 -6.148355000 -9.881849000 0 0 0 # hc 117 8 2 -0.159000 7.166774000 -9.625239000 -6.960353000 0 0 0 # c3 118 8 5 0.053000 7.098119000 -10.241527000 -6.050359000 0 0 0 # hc 119 8 5 0.053000 7.344500000 -10.294304000 -7.814393000 0 0 0 # hc 120 8 5 0.053000 6.177875000 -9.159550000 -7.097847000 0 0 0 # hc 121 8 6 -0.133000 9.457828000 -7.401923000 -8.564177000 0 0 0 # o_1 122 9 1 0.000000 10.528174000 -10.165533000 -6.728540000 0 0 0 # c 123 9 7 -0.106000 9.586302000 -9.079899000 -6.157574000 0 0 0 # c2 124 9 3 0.266000 9.693571000 -11.386060000 -7.060668000 0 0 0 # c_1 125 9 4 -0.266000 9.222904000 -11.936493000 -5.924360000 0 0 0 # o_2 126 9 2 -0.026000 8.442799000 -13.113503000 -6.108579000 0 0 0 # c3 127 9 5 0.053000 8.109656000 -13.475726000 -5.126573000 0 0 0 # hc 128 9 5 0.053000 9.056854000 -13.883047000 -6.596524000 0 0 0 # hc 129 9 5 0.053000 10.218024000 -8.201376000 -5.957354000 0 0 0 # hc 130 9 5 0.053000 9.284047000 -9.466335000 -5.169165000 0 0 0 # hc 131 9 5 0.053000 7.568042000 -12.877858000 -6.730325000 0 0 0 # hc 132 9 2 -0.159000 11.397504000 -10.560489000 -5.522103000 0 0 0 # c3 133 9 5 0.053000 12.053299000 -9.720169000 -5.250118000 0 0 0 # hc 134 9 5 0.053000 12.029275000 -11.435398000 -5.737741000 0 0 0 # hc 135 9 5 0.053000 10.802796000 -10.790915000 -4.624592000 0 0 0 # hc 136 9 6 -0.133000 9.465161000 -11.823378000 -8.154997000 0 0 0 # o_1 137 10 5 0.053000 12.889411000 -8.809349000 -9.008053000 0 0 0 # hc 138 10 8 -0.053000 12.617346000 -8.953444000 -7.946761000 0 0 0 # c1 139 10 7 -0.106000 11.358317000 -9.861743000 -7.993068000 0 0 0 # c2 140 10 3 0.266000 13.813210000 -9.651723000 -7.309744000 0 0 0 # c_1 141 10 4 -0.266000 13.878794000 -10.934779000 -7.716185000 0 0 0 # o_2 142 10 2 -0.026000 14.959498000 -11.682905000 -7.168796000 0 0 0 # c3 143 10 5 0.053000 14.919297000 -12.707115000 -7.564129000 0 0 0 # hc 144 10 5 0.053000 14.866795000 -11.707441000 -6.074044000 0 0 0 # hc 145 10 5 0.053000 11.681983000 -10.834435000 -8.402314000 0 0 0 # hc 146 10 5 0.053000 10.693673000 -9.457714000 -8.772422000 0 0 0 # hc 147 10 5 0.053000 15.910415000 -11.213947000 -7.457781000 0 0 0 # hc 148 10 2 -0.159000 12.527455000 -7.566814000 -7.315882000 0 0 0 # c3 149 10 5 0.053000 11.733374000 -6.969615000 -7.782074000 0 0 0 # hc 150 10 5 0.053000 13.478407000 -7.035564000 -7.479820000 0 0 0 # hc 151 10 5 0.053000 12.347673000 -7.613591000 -6.232621000 0 0 0 # hc 152 10 6 -0.133000 14.596719000 -9.153044000 -6.549874000 0 0 0 # o_1 Bonds 1 1 1 3 2 2 1 2 3 2 1 12 4 3 1 18 5 4 2 7 6 4 2 9 7 4 2 10 8 5 3 4 9 6 3 16 10 7 5 4 11 4 5 6 12 4 5 8 13 4 5 11 14 4 12 13 15 4 12 14 16 4 12 15 17 1 17 19 18 3 17 18 19 2 17 27 20 3 17 33 21 8 24 18 22 8 25 18 23 5 19 20 24 6 19 31 25 7 21 20 26 4 21 22 27 4 21 23 28 4 21 26 29 4 27 28 30 4 27 29 31 4 27 30 32 1 32 34 33 3 32 33 34 2 32 42 35 3 32 48 36 8 39 33 37 8 40 33 38 5 34 35 39 6 34 46 40 7 36 35 41 4 36 37 42 4 36 38 43 4 36 41 44 4 42 43 45 4 42 44 46 4 42 45 47 1 47 49 48 3 47 48 49 2 47 57 50 3 47 63 51 8 54 48 52 8 55 48 53 5 49 50 54 6 49 61 55 7 51 50 56 4 51 52 57 4 51 53 58 4 51 56 59 4 57 58 60 4 57 59 61 4 57 60 62 1 62 64 63 3 62 63 64 2 62 72 65 3 62 78 66 8 69 63 67 8 70 63 68 5 64 65 69 6 64 76 70 7 66 65 71 4 66 67 72 4 66 68 73 4 66 71 74 4 72 73 75 4 72 74 76 4 72 75 77 1 77 79 78 3 77 78 79 2 77 87 80 3 77 93 81 8 84 78 82 8 85 78 83 5 79 80 84 6 79 91 85 7 81 80 86 4 81 82 87 4 81 83 88 4 81 86 89 4 87 88 90 4 87 89 91 4 87 90 92 1 92 94 93 3 92 93 94 2 92 102 95 3 92 108 96 8 99 93 97 8 100 93 98 5 94 95 99 6 94 106 100 7 96 95 101 4 96 97 102 4 96 98 103 4 96 101 104 4 102 103 105 4 102 104 106 4 102 105 107 1 107 109 108 3 107 108 109 2 107 117 110 3 107 123 111 8 114 108 112 8 115 108 113 5 109 110 114 6 109 121 115 7 111 110 116 4 111 112 117 4 111 113 118 4 111 116 119 4 117 118 120 4 117 119 121 4 117 120 122 1 122 124 123 3 122 123 124 2 122 132 125 3 122 139 126 8 129 123 127 8 130 123 128 5 124 125 129 6 124 136 130 7 126 125 131 4 126 127 132 4 126 128 133 4 126 131 134 4 132 133 135 4 132 134 136 4 132 135 137 9 137 138 138 10 140 138 139 11 139 138 140 12 148 138 141 8 145 139 142 8 146 139 143 5 140 141 144 6 140 152 145 7 142 141 146 4 142 143 147 4 142 144 148 4 142 147 149 4 148 149 150 4 148 150 151 4 148 151 Angles 1 1 2 1 3 2 1 12 1 3 3 2 3 1 18 4 3 2 1 12 5 4 2 1 18 6 4 12 1 18 7 5 7 2 9 8 5 7 2 10 9 6 1 2 7 10 5 9 2 10 11 6 1 2 9 12 6 1 2 10 13 7 1 3 4 14 8 1 3 16 15 9 4 3 16 16 10 5 4 3 17 11 4 5 6 18 11 4 5 8 19 11 4 5 11 20 5 6 5 8 21 5 6 5 11 22 5 8 5 11 23 5 13 12 14 24 5 13 12 15 25 6 1 12 13 26 5 14 12 15 27 6 1 12 14 28 6 1 12 15 29 2 19 17 18 30 1 27 17 19 31 2 19 17 33 32 4 27 17 18 33 12 18 17 33 34 4 27 17 33 35 13 24 18 25 36 14 17 18 24 37 14 1 18 24 38 14 17 18 25 39 14 1 18 25 40 15 17 18 1 41 7 17 19 20 42 8 17 19 31 43 9 20 19 31 44 10 21 20 19 45 11 20 21 22 46 11 20 21 23 47 11 20 21 26 48 5 22 21 23 49 5 22 21 26 50 5 23 21 26 51 5 28 27 29 52 5 28 27 30 53 6 17 27 28 54 5 29 27 30 55 6 17 27 29 56 6 17 27 30 57 2 34 32 33 58 1 42 32 34 59 2 34 32 48 60 4 42 32 33 61 12 33 32 48 62 4 42 32 48 63 13 39 33 40 64 14 32 33 39 65 14 17 33 39 66 14 32 33 40 67 14 17 33 40 68 15 32 33 17 69 7 32 34 35 70 8 32 34 46 71 9 35 34 46 72 10 36 35 34 73 11 35 36 37 74 11 35 36 38 75 11 35 36 41 76 5 37 36 38 77 5 37 36 41 78 5 38 36 41 79 5 43 42 44 80 5 43 42 45 81 6 32 42 43 82 5 44 42 45 83 6 32 42 44 84 6 32 42 45 85 2 49 47 48 86 1 57 47 49 87 2 49 47 63 88 4 57 47 48 89 12 48 47 63 90 4 57 47 63 91 13 54 48 55 92 14 47 48 54 93 14 32 48 54 94 14 47 48 55 95 14 32 48 55 96 15 47 48 32 97 7 47 49 50 98 8 47 49 61 99 9 50 49 61 100 10 51 50 49 101 11 50 51 52 102 11 50 51 53 103 11 50 51 56 104 5 52 51 53 105 5 52 51 56 106 5 53 51 56 107 5 58 57 59 108 5 58 57 60 109 6 47 57 58 110 5 59 57 60 111 6 47 57 59 112 6 47 57 60 113 2 64 62 63 114 1 72 62 64 115 2 64 62 78 116 4 72 62 63 117 12 63 62 78 118 4 72 62 78 119 13 69 63 70 120 14 62 63 69 121 14 47 63 69 122 14 62 63 70 123 14 47 63 70 124 15 62 63 47 125 7 62 64 65 126 8 62 64 76 127 9 65 64 76 128 10 66 65 64 129 11 65 66 67 130 11 65 66 68 131 11 65 66 71 132 5 67 66 68 133 5 67 66 71 134 5 68 66 71 135 5 73 72 74 136 5 73 72 75 137 6 62 72 73 138 5 74 72 75 139 6 62 72 74 140 6 62 72 75 141 2 79 77 78 142 1 87 77 79 143 2 79 77 93 144 4 87 77 78 145 12 78 77 93 146 4 87 77 93 147 13 84 78 85 148 14 77 78 84 149 14 62 78 84 150 14 77 78 85 151 14 62 78 85 152 15 77 78 62 153 7 77 79 80 154 8 77 79 91 155 9 80 79 91 156 10 81 80 79 157 11 80 81 82 158 11 80 81 83 159 11 80 81 86 160 5 82 81 83 161 5 82 81 86 162 5 83 81 86 163 5 88 87 89 164 5 88 87 90 165 6 77 87 88 166 5 89 87 90 167 6 77 87 89 168 6 77 87 90 169 2 94 92 93 170 1 102 92 94 171 2 94 92 108 172 4 102 92 93 173 12 93 92 108 174 4 102 92 108 175 13 99 93 100 176 14 92 93 99 177 14 77 93 99 178 14 92 93 100 179 14 77 93 100 180 15 92 93 77 181 7 92 94 95 182 8 92 94 106 183 9 95 94 106 184 10 96 95 94 185 11 95 96 97 186 11 95 96 98 187 11 95 96 101 188 5 97 96 98 189 5 97 96 101 190 5 98 96 101 191 5 103 102 104 192 5 103 102 105 193 6 92 102 103 194 5 104 102 105 195 6 92 102 104 196 6 92 102 105 197 2 109 107 108 198 1 117 107 109 199 2 109 107 123 200 4 117 107 108 201 12 108 107 123 202 4 117 107 123 203 13 114 108 115 204 14 107 108 114 205 14 92 108 114 206 14 107 108 115 207 14 92 108 115 208 15 107 108 92 209 7 107 109 110 210 8 107 109 121 211 9 110 109 121 212 10 111 110 109 213 11 110 111 112 214 11 110 111 113 215 11 110 111 116 216 5 112 111 113 217 5 112 111 116 218 5 113 111 116 219 5 118 117 119 220 5 118 117 120 221 6 107 117 118 222 5 119 117 120 223 6 107 117 119 224 6 107 117 120 225 2 124 122 123 226 1 132 122 124 227 2 124 122 139 228 4 132 122 123 229 12 123 122 139 230 4 132 122 139 231 13 129 123 130 232 14 122 123 129 233 14 107 123 129 234 14 122 123 130 235 14 107 123 130 236 15 122 123 107 237 7 122 124 125 238 8 122 124 136 239 9 125 124 136 240 10 126 125 124 241 11 125 126 127 242 11 125 126 128 243 11 125 126 131 244 5 127 126 128 245 5 127 126 131 246 5 128 126 131 247 5 133 132 134 248 5 133 132 135 249 6 122 132 133 250 5 134 132 135 251 6 122 132 134 252 6 122 132 135 253 16 140 138 137 254 17 137 138 139 255 18 148 138 137 256 19 140 138 139 257 20 148 138 140 258 21 148 138 139 259 13 145 139 146 260 22 145 139 138 261 14 122 139 145 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