355 lines
15 KiB
Plaintext
355 lines
15 KiB
Plaintext
VOTCA
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N 351 R 2.0 9.0
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1 2.000000E+00 2.190202E+01 7.229762E+01
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2 2.020000E+00 2.048957E+01 6.887333E+01
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3 2.040000E+00 1.915004E+01 6.500604E+01
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4 2.060000E+00 1.789228E+01 6.069573E+01
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5 2.080000E+00 1.672516E+01 5.594242E+01
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6 2.100000E+00 1.565754E+01 5.074609E+01
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7 2.120000E+00 1.467088E+01 4.787307E+01
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8 2.140000E+00 1.374450E+01 4.471740E+01
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9 2.160000E+00 1.288407E+01 4.127908E+01
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10 2.180000E+00 1.209522E+01 3.755811E+01
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11 2.200000E+00 1.138363E+01 3.355449E+01
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12 2.220000E+00 1.072913E+01 3.188695E+01
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13 2.240000E+00 1.010845E+01 3.017359E+01
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14 2.260000E+00 9.522496E+00 2.841440E+01
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15 2.280000E+00 8.972182E+00 2.660938E+01
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16 2.300000E+00 8.458426E+00 2.475854E+01
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27 2.520000E+00 2.547993E+00 2.297813E+01
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28 2.540000E+00 2.115131E+00 2.025763E+01
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29 2.560000E+00 1.739702E+00 1.723497E+01
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30 2.580000E+00 1.427747E+00 1.391013E+01
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31 2.600000E+00 1.185311E+00 1.028314E+01
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32 2.620000E+00 9.860176E-01 9.578245E+00
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33 2.640000E+00 8.048986E-01 8.465708E+00
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34 2.660000E+00 6.501069E-01 6.945526E+00
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35 2.680000E+00 5.297952E-01 5.017699E+00
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36 2.700000E+00 4.521166E-01 2.682227E+00
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37 2.720000E+00 3.986447E-01 2.615311E+00
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38 2.740000E+00 3.494900E-01 2.250522E+00
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39 2.760000E+00 3.106097E-01 1.587859E+00
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40 2.780000E+00 2.879614E-01 6.273237E-01
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41 2.800000E+00 2.875026E-01 -6.310851E-01
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43 2.840000E+00 3.140112E-01 -7.277911E-01
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44 2.860000E+00 3.297194E-01 -8.513935E-01
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46 2.900000E+00 3.710604E-01 -1.249097E+00
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47 2.920000E+00 3.974884E-01 -1.380483E+00
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48 2.940000E+00 4.257507E-01 -1.432530E+00
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49 2.960000E+00 4.542607E-01 -1.405240E+00
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50 2.980000E+00 4.814314E-01 -1.298611E+00
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51 3.000000E+00 5.056762E-01 -1.112645E+00
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52 3.020000E+00 5.266502E-01 -9.832894E-01
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53 3.040000E+00 5.449492E-01 -8.451544E-01
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54 3.060000E+00 5.603978E-01 -6.982396E-01
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55 3.080000E+00 5.728203E-01 -5.425450E-01
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56 3.100000E+00 5.820411E-01 -3.780706E-01
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57 3.120000E+00 5.882509E-01 -2.409307E-01
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58 3.140000E+00 5.915991E-01 -9.190908E-02
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59 3.160000E+00 5.918481E-01 6.899430E-02
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60 3.180000E+00 5.887601E-01 2.417794E-01
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61 3.200000E+00 5.820977E-01 4.264463E-01
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63 3.240000E+00 5.638075E-01 5.057356E-01
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64 3.260000E+00 5.529429E-01 5.851503E-01
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65 3.280000E+00 5.402248E-01 6.910784E-01
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66 3.300000E+00 5.251230E-01 8.235199E-01
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68 3.340000E+00 4.921725E-01 8.244583E-01
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69 3.360000E+00 4.756696E-01 8.259503E-01
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70 3.380000E+00 4.591299E-01 8.281240E-01
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71 3.400000E+00 4.425400E-01 8.309796E-01
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72 3.420000E+00 4.259181E-01 8.311861E-01
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73 3.440000E+00 4.092937E-01 8.312292E-01
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74 3.460000E+00 3.926700E-01 8.311089E-01
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75 3.480000E+00 3.760504E-01 8.308252E-01
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76 3.500000E+00 3.594381E-01 8.303781E-01
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77 3.520000E+00 3.428394E-01 8.295412E-01
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80 3.580000E+00 2.931071E-01 8.285923E-01
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81 3.600000E+00 2.765336E-01 8.287966E-01
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82 3.620000E+00 2.599901E-01 8.254306E-01
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83 3.640000E+00 2.435212E-01 8.213359E-01
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84 3.660000E+00 2.271415E-01 8.165124E-01
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85 3.680000E+00 2.108656E-01 8.109603E-01
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86 3.700000E+00 1.947080E-01 8.046794E-01
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87 3.720000E+00 1.790243E-01 7.653050E-01
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88 3.740000E+00 1.640312E-01 7.356166E-01
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89 3.760000E+00 1.495351E-01 7.156143E-01
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90 3.780000E+00 1.353421E-01 7.052980E-01
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91 3.800000E+00 1.212586E-01 7.046676E-01
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92 3.820000E+00 1.072429E-01 6.965706E-01
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93 3.840000E+00 9.340878E-02 6.865180E-01
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94 3.860000E+00 7.979524E-02 6.745098E-01
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95 3.880000E+00 6.644142E-02 6.605462E-01
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96 3.900000E+00 5.338643E-02 6.446270E-01
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97 3.920000E+00 4.067486E-02 6.268536E-01
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98 3.940000E+00 2.829935E-02 6.110218E-01
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99 3.960000E+00 1.622105E-02 5.971317E-01
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100 3.980000E+00 4.401131E-03 5.851833E-01
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101 4.000000E+00 -7.199230E-03 5.751764E-01
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102 4.020000E+00 -1.856170E-02 5.611971E-01
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103 4.040000E+00 -2.965216E-02 5.479743E-01
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104 4.060000E+00 -4.048572E-02 5.355079E-01
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105 4.080000E+00 -5.107752E-02 5.237981E-01
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106 4.100000E+00 -6.144268E-02 5.128447E-01
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107 4.120000E+00 -7.151117E-02 4.939504E-01
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108 4.140000E+00 -8.119856E-02 4.747353E-01
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109 4.160000E+00 -9.049845E-02 4.551994E-01
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110 4.180000E+00 -9.940440E-02 4.353427E-01
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111 4.200000E+00 -1.079100E-01 4.151651E-01
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112 4.220000E+00 -1.159565E-01 3.900062E-01
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115 4.280000E+00 -1.375164E-01 3.333651E-01
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117 4.320000E+00 -1.503014E-01 3.040292E-01
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118 4.340000E+00 -1.562092E-01 2.866389E-01
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119 4.360000E+00 -1.617626E-01 2.685925E-01
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120 4.380000E+00 -1.669485E-01 2.498899E-01
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121 4.400000E+00 -1.717538E-01 2.305311E-01
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122 4.420000E+00 -1.760941E-01 2.036400E-01
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123 4.440000E+00 -1.799054E-01 1.776469E-01
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124 4.460000E+00 -1.832059E-01 1.525518E-01
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126 4.500000E+00 -1.883461E-01 1.050554E-01
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127 4.520000E+00 -1.902569E-01 8.558005E-02
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128 4.540000E+00 -1.917515E-01 6.344105E-02
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130 4.580000E+00 -1.932793E-01 1.117216E-02
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131 4.600000E+00 -1.932059E-01 -1.895774E-02
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133 4.640000E+00 -1.918741E-01 -4.753697E-02
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