NISPEL_charged 8.577000 0.000000 0.000000 -4.288534 12.998523 0.000000 0.000000 -1.092127 25.798894 1 -0.369264 -0.369264 -0.369264 30[8-(15),8-(15),8-(6),8-(6)] 2 4.2287 4.2287 4.2287 30[8-(15),8-(15),8-(15),8-(15)] 3 3.919251 3.919251 3.919251 30[8-(15),8-(15),8-(6),8-(6)] 4 -0.059797 -0.059797 -0.059797 30[8-(15),8-(15),8-(15),8-(15)] 5 4.65773 4.65773 4.65773 30[8-(15),8-(15),8-(6),8-(6)] 6 0.059766 0.059766 0.059766 30[8-(15),8-(15),8-(15),8-(15)] 7 0.369215 0.369215 0.369215 30[8-(15),8-(15),8-(6),8-(6)] 8 4.348263 4.348263 4.348263 30[8-(15),8-(15),8-(15),8-(15)] 9 -1.716538 -1.716538 -1.716538 15[6-(6,6),8-(30),8-(30),8-(30)] 10 2.03153 2.03153 2.03153 15[6-(6,6),8-(30),8-(30),8-(30)] 11 2.571974 2.571974 2.571974 15[6-(6,6),8-(30),8-(30),8-(30)] 12 6.320033 6.320033 6.320033 15[6-(6,6),8-(30),8-(30),8-(30)] 13 6.005004 6.005004 6.005004 15[6-(6,6),8-(30),8-(30),8-(30)] 14 2.256936 2.256936 2.256936 15[6-(6,6),8-(30),8-(30),8-(30)] 15 1.716492 1.716492 1.716492 15[6-(6,6),8-(30),8-(30),8-(30)] 16 -2.031567 -2.031567 -2.031567 15[6-(6,6),8-(30),8-(30),8-(30)] 17 -2.728373 -2.728373 -2.728373 1[6-(6,6)] 18 2.469318 2.469318 2.469318 1[6-(6,6)] 19 1.821724 1.821724 1.821724 1[6-(6,6)] 20 0.893698 0.893698 0.893698 1[6-(6,6)] 21 3.782444 3.782444 3.782444 1[6-(6,6)] 22 4.25504 4.25504 4.25504 1[6-(6,6)] 23 1.928094 1.928094 1.928094 1[6-(6,6)] 24 1.448636 1.448636 1.448636 1[6-(6,6)] 25 1.560151 1.560151 1.560151 1[6-(6,6)] 26 -1.819215 -1.819215 -1.819215 1[6-(6,6)] 27 6.110251 6.110251 6.110251 1[6-(6,6)] 28 5.182215 5.182215 5.182215 1[6-(6,6)] 29 -0.506064 -0.506064 -0.506064 1[6-(6,6)] 30 -0.033475 -0.033475 -0.033475 1[6-(6,6)] 31 6.216591 6.216591 6.216591 1[6-(6,6)] 32 5.73714 5.73714 5.73714 1[6-(6,6)] 33 7.016839 7.016839 7.016839 1[6-(6,6)] 34 1.819148 1.819148 1.819148 1[6-(6,6)] 35 2.466742 2.466742 2.466742 1[6-(6,6)] 36 3.394768 3.394768 3.394768 1[6-(6,6)] 37 0.506022 0.506022 0.506022 1[6-(6,6)] 38 0.033426 0.033426 0.033426 1[6-(6,6)] 39 2.360372 2.360372 2.360372 1[6-(6,6)] 40 2.83983 2.83983 2.83983 1[6-(6,6)] 41 2.728315 2.728315 2.728315 1[6-(6,6)] 42 6.107681 6.107681 6.107681 1[6-(6,6)] 43 -1.821785 -1.821785 -1.821785 1[6-(6,6)] 44 -0.893749 -0.893749 -0.893749 1[6-(6,6)] 45 4.79453 4.79453 4.79453 1[6-(6,6)] 46 4.321941 4.321941 4.321941 1[6-(6,6)] 47 -1.928125 -1.928125 -1.928125 1[6-(6,6)] 48 -1.448674 -1.448674 -1.448674 1[6-(6,6)] 49 0.030867 0.030867 0.030867 1[7-(1,6,6)] 50 7.563191 7.563191 7.563191 1[7-(1,6,6)] 51 -0.417709 -0.417709 -0.417709 1[6-(1,1,7)] 52 -0.054041 -0.054041 -0.054041 1[6-(1,1,7)] 53 1.060109 1.060109 1.060109 1[6-(1,1,7)] 54 0.349078 0.349078 0.349078 1[6-(1,1,7)] 55 1.550716 1.550716 1.550716 1[6-(1,1,7)] 56 0.428847 0.428847 0.428847 1[6-(1,1,7)] 57 4.319353 4.319353 4.319353 1[7-(1,6,6)] 58 3.274672 3.274672 3.274672 1[7-(1,6,6)] 59 3.870776 3.870776 3.870776 1[6-(1,1,7)] 60 4.234436 4.234436 4.234436 1[6-(1,1,7)] 61 -3.228408 -3.228408 -3.228408 1[6-(1,1,7)] 62 4.637556 4.637556 4.637556 1[6-(1,1,7)] 63 -2.737806 -2.737806 -2.737806 1[6-(1,1,7)] 64 -3.859681 -3.859681 -3.859681 1[6-(1,1,7)] 65 4.257599 4.257599 4.257599 1[7-(1,6,6)] 66 -3.274725 -3.274725 -3.274725 1[7-(1,6,6)] 67 4.706175 4.706175 4.706175 1[6-(1,1,7)] 68 4.342507 4.342507 4.342507 1[6-(1,1,7)] 69 3.228357 3.228357 3.228357 1[6-(1,1,7)] 70 3.939388 3.939388 3.939388 1[6-(1,1,7)] 71 2.73775 2.73775 2.73775 1[6-(1,1,7)] 72 3.859619 3.859619 3.859619 1[6-(1,1,7)] 73 -0.030887 -0.030887 -0.030887 1[7-(1,6,6)] 74 1.013794 1.013794 1.013794 1[7-(1,6,6)] 75 0.41769 0.41769 0.41769 1[6-(1,1,7)] 76 0.05403 0.05403 0.05403 1[6-(1,1,7)] 77 -1.060126 -1.060126 -1.060126 1[6-(1,1,7)] 78 -0.34909 -0.34909 -0.34909 1[6-(1,1,7)] 79 7.026272 7.026272 7.026272 1[6-(1,1,7)] 80 -0.428853 -0.428853 -0.428853 1[6-(1,1,7)] 81 -1.02069 -1.02069 -1.02069 6[6-(1,6),6-(1,6),15-(8,8,8)] 82 -1.803772 -1.803772 -1.803772 6[1-(0),6-(1,6),6-(6,15)] 83 -1.257421 -1.257421 -1.257421 6[1-(0),6-(1,6),6-(6,6)] 84 0.097745 0.097745 0.097745 6[6-(1,6),6-(1,6),6-(8,8)] 85 0.896266 0.896266 0.896266 6[1-(0),6-(1,6),6-(6,6)] 86 0.336191 0.336191 0.336191 6[1-(0),6-(1,6),6-(6,15)] 87 4.950642 4.950642 4.950642 6[6-(6,6),8-(0),8-(30)] 88 2.500179 2.500179 2.500179 6[6-(1,6),6-(1,6),15-(8,8,8)] 89 3.380182 3.380182 3.380182 6[1-(0),6-(1,6),6-(6,15)] 90 3.688098 3.688098 3.688098 6[1-(0),6-(1,6),6-(6,6)] 91 3.182055 3.182055 3.182055 6[6-(1,6),6-(1,6),6-(8,8)] 92 2.321779 2.321779 2.321779 6[1-(0),6-(1,6),6-(6,6)] 93 2.007001 2.007001 2.007001 6[1-(0),6-(1,6),6-(6,15)] 94 3.614337 3.614337 3.614337 6[6-(6,6),8-(0),8-(30)] 95 3.26783 3.26783 3.26783 6[6-(1,6),6-(1,6),15-(8,8,8)] 96 2.484752 2.484752 2.484752 6[1-(0),6-(1,6),6-(6,15)] 97 3.03111 3.03111 3.03111 6[1-(0),6-(1,6),6-(6,6)] 98 4.386277 4.386277 4.386277 6[6-(1,6),6-(1,6),6-(8,8)] 99 5.184793 5.184793 5.184793 6[1-(0),6-(1,6),6-(6,6)] 100 4.624711 4.624711 4.624711 6[1-(0),6-(1,6),6-(6,15)] 101 0.662113 0.662113 0.662113 6[6-(6,6),8-(0),8-(30)] 102 -1.788322 -1.788322 -1.788322 6[6-(1,6),6-(1,6),15-(8,8,8)] 103 -0.908325 -0.908325 -0.908325 6[1-(0),6-(1,6),6-(6,15)] 104 -0.600412 -0.600412 -0.600412 6[1-(0),6-(1,6),6-(6,6)] 105 -1.106455 -1.106455 -1.106455 6[6-(1,6),6-(1,6),6-(8,8)] 106 -1.966725 -1.966725 -1.966725 6[1-(0),6-(1,6),6-(6,6)] 107 6.295501 6.295501 6.295501 6[1-(0),6-(1,6),6-(6,15)] 108 -0.674176 -0.674176 -0.674176 6[6-(6,6),8-(0),8-(30)] 109 5.309156 5.309156 5.309156 6[6-(1,6),6-(1,6),15-(8,8,8)] 110 6.092238 6.092238 6.092238 6[1-(0),6-(1,6),6-(6,15)] 111 5.545887 5.545887 5.545887 6[1-(0),6-(1,6),6-(6,6)] 112 4.190721 4.190721 4.190721 6[6-(1,6),6-(1,6),6-(8,8)] 113 3.3922 3.3922 3.3922 6[1-(0),6-(1,6),6-(6,6)] 114 3.952275 3.952275 3.952275 6[1-(0),6-(1,6),6-(6,15)] 115 -0.662176 -0.662176 -0.662176 6[6-(6,6),8-(0),8-(30)] 116 1.788287 1.788287 1.788287 6[6-(1,6),6-(1,6),15-(8,8,8)] 117 0.908284 0.908284 0.908284 6[1-(0),6-(1,6),6-(6,15)] 118 0.600368 0.600368 0.600368 6[1-(0),6-(1,6),6-(6,6)] 119 1.106411 1.106411 1.106411 6[6-(1,6),6-(1,6),6-(8,8)] 120 1.966687 1.966687 1.966687 6[1-(0),6-(1,6),6-(6,6)] 121 2.281465 2.281465 2.281465 6[1-(0),6-(1,6),6-(6,15)] 122 0.674129 0.674129 0.674129 6[6-(6,6),8-(0),8-(30)] 123 1.020636 1.020636 1.020636 6[6-(1,6),6-(1,6),15-(8,8,8)] 124 1.803714 1.803714 1.803714 6[1-(0),6-(1,6),6-(6,15)] 125 1.257356 1.257356 1.257356 6[1-(0),6-(1,6),6-(6,6)] 126 -0.097811 -0.097811 -0.097811 6[6-(1,6),6-(1,6),6-(8,8)] 127 -0.896327 -0.896327 -0.896327 6[1-(0),6-(1,6),6-(6,6)] 128 -0.336245 -0.336245 -0.336245 6[1-(0),6-(1,6),6-(6,15)] 129 3.626353 3.626353 3.626353 6[6-(6,6),8-(0),8-(30)] 130 6.076788 6.076788 6.076788 6[6-(1,6),6-(1,6),15-(8,8,8)] 131 5.196791 5.196791 5.196791 6[1-(0),6-(1,6),6-(6,15)] 132 4.888878 4.888878 4.888878 6[1-(0),6-(1,6),6-(6,6)] 133 5.394921 5.394921 5.394921 6[6-(1,6),6-(1,6),6-(8,8)] 134 6.255191 6.255191 6.255191 6[1-(0),6-(1,6),6-(6,6)] 135 -2.007035 -2.007035 -2.007035 6[1-(0),6-(1,6),6-(6,15)] 136 4.962642 4.962642 4.962642 6[6-(6,6),8-(0),8-(30)] 137 0.136366 0.136366 0.136366 6[1-(0),1-(0),1-(0),7-(1,1,6)] 138 0.611535 0.611535 0.611535 6[1-(0),1-(0),1-(0),7-(1,1,6)] 139 4.424848 4.424848 4.424848 6[1-(0),1-(0),1-(0),7-(1,1,6)] 140 4.900012 4.900012 4.900012 6[1-(0),1-(0),1-(0),7-(1,1,6)] 141 4.1521 4.1521 4.1521 6[1-(0),1-(0),1-(0),7-(1,1,6)] 142 3.676931 3.676931 3.676931 6[1-(0),1-(0),1-(0),7-(1,1,6)] 143 -0.136382 -0.136382 -0.136382 6[1-(0),1-(0),1-(0),7-(1,1,6)] 144 -0.611546 -0.611546 -0.611546 6[1-(0),1-(0),1-(0),7-(1,1,6)] 145 -1.665676 -1.665676 -1.665676 8[15-(6,8,8),30-(8,8,8)] 146 5.405203 5.405203 5.405203 8[15-(6,8,8),30-(8,8,8)] 147 -0.877447 -0.877447 -0.877447 8[15-(6,8,8),30-(8,8,8)] 148 4.111809 4.111809 4.111809 8[6-(6,8),30-(8,8,8)] 149 6.193449 6.193449 6.193449 8[6-(6,8)] 150 3.319279 3.319279 3.319279 8[15-(6,8,8),30-(8,8,8)] 151 1.244507 1.244507 1.244507 8[15-(6,8,8),30-(8,8,8)] 152 1.277093 1.277093 1.277093 8[15-(6,8,8),30-(8,8,8)] 153 4.515782 4.515782 4.515782 8[6-(6,8)] 154 3.064551 3.064551 3.064551 8[6-(6,8),30-(8,8,8)] 155 2.622835 2.622835 2.622835 8[15-(6,8,8),30-(8,8,8)] 156 1.116714 1.116714 1.116714 8[15-(6,8,8),30-(8,8,8)] 157 3.411059 3.411059 3.411059 8[15-(6,8,8),30-(8,8,8)] 158 -0.176715 -0.176715 -0.176715 8[6-(6,8),30-(8,8,8)] 159 1.90492 1.90492 1.90492 8[6-(6,8)] 160 -0.969215 -0.969215 -0.969215 8[15-(6,8,8),30-(8,8,8)] 161 5.533005 5.533005 5.533005 8[15-(6,8,8),30-(8,8,8)] 162 5.565603 5.565603 5.565603 8[15-(6,8,8),30-(8,8,8)] 163 0.227265 0.227265 0.227265 8[6-(6,8)] 164 -1.223961 -1.223961 -1.223961 8[6-(6,8),30-(8,8,8)] 165 5.954142 5.954142 5.954142 8[15-(6,8,8),30-(8,8,8)] 166 -1.116737 -1.116737 -1.116737 8[15-(6,8,8),30-(8,8,8)] 167 5.165913 5.165913 5.165913 8[15-(6,8,8),30-(8,8,8)] 168 0.176657 0.176657 0.176657 8[6-(6,8),30-(8,8,8)] 169 -1.904983 -1.904983 -1.904983 8[6-(6,8)] 170 0.969187 0.969187 0.969187 8[15-(6,8,8),30-(8,8,8)] 171 3.043959 3.043959 3.043959 8[15-(6,8,8),30-(8,8,8)] 172 3.011373 3.011373 3.011373 8[15-(6,8,8),30-(8,8,8)] 173 -0.227316 -0.227316 -0.227316 8[6-(6,8)] 174 1.223915 1.223915 1.223915 8[6-(6,8),30-(8,8,8)] 175 1.665631 1.665631 1.665631 8[15-(6,8,8),30-(8,8,8)] 176 3.171752 3.171752 3.171752 8[15-(6,8,8),30-(8,8,8)] 177 0.877407 0.877407 0.877407 8[15-(6,8,8),30-(8,8,8)] 178 4.465181 4.465181 4.465181 8[6-(6,8),30-(8,8,8)] 179 2.383546 2.383546 2.383546 8[6-(6,8)] 180 5.257681 5.257681 5.257681 8[15-(6,8,8),30-(8,8,8)] 181 -1.244539 -1.244539 -1.244539 8[15-(6,8,8),30-(8,8,8)] 182 -1.277137 -1.277137 -1.277137 8[15-(6,8,8),30-(8,8,8)] 183 4.061201 4.061201 4.061201 8[6-(6,8)] 184 5.512427 5.512427 5.512427 8[6-(6,8),30-(8,8,8)] 185 -0.136382 -0.136382 -0.136382 7[1-(0),1-(0),6-(1,1,1),6-(1,1,1)] 186 4.1521 4.1521 4.1521 7[1-(0),1-(0),6-(1,1,1),6-(1,1,1)] 187 4.424848 4.424848 4.424848 7[1-(0),1-(0),6-(1,1,1),6-(1,1,1)] 188 0.136366 0.136366 0.136366 7[1-(0),1-(0),6-(1,1,1),6-(1,1,1)]