VEGMIE_charged 9.834000 0.000000 0.000000 -4.917125 16.655429 0.000000 0.000000 -0.750211 18.280613 1 -1.976327 -1.976327 -1.976327 27[8-(6),8-(6),8-(6),8-(6)] 2 2.940721 2.940721 2.940721 27[8-(6),8-(6),8-(6),8-(6)] 3 6.893202 6.893202 6.893202 27[8-(6),8-(6),8-(6),8-(6)] 4 1.976154 1.976154 1.976154 27[8-(6),8-(6),8-(6),8-(6)] 5 -2.458562 -2.458562 -2.458562 27[8-(6),8-(6),8-(6),8-(6)] 6 2.458437 2.458437 2.458437 27[8-(6),8-(6),8-(6),8-(6)] 7 1.166196 1.166196 1.166196 1[6-(6,6)] 8 -1.61781 -1.61781 -1.61781 1[6-(6,6)] 9 2.399425 2.399425 2.399425 1[6-(6,6)] 10 0.625379 0.625379 0.625379 1[6-(6,6)] 11 6.152059 6.152059 6.152059 1[6-(6,6)] 12 4.98673 4.98673 4.98673 1[6-(6,6)] 13 3.764392 3.764392 3.764392 1[6-(6,6)] 14 4.882517 4.882517 4.882517 1[6-(6,6)] 15 6.083304 6.083304 6.083304 1[6-(6,6)] 16 3.299299 3.299299 3.299299 1[6-(6,6)] 17 7.316442 7.316442 7.316442 1[6-(6,6)] 18 5.542381 5.542381 5.542381 1[6-(6,6)] 19 1.235117 1.235117 1.235117 1[6-(6,6)] 20 0.069787 0.069787 0.069787 1[6-(6,6)] 21 -1.152607 -1.152607 -1.152607 1[6-(6,6)] 22 -0.03448 -0.03448 -0.03448 1[6-(6,6)] 23 3.750679 3.750679 3.750679 1[6-(6,6)] 24 6.534685 6.534685 6.534685 1[6-(6,6)] 25 2.51745 2.51745 2.51745 1[6-(6,6)] 26 4.291496 4.291496 4.291496 1[6-(6,6)] 27 -1.235184 -1.235184 -1.235184 1[6-(6,6)] 28 -0.069855 -0.069855 -0.069855 1[6-(6,6)] 29 1.152483 1.152483 1.152483 1[6-(6,6)] 30 0.034358 0.034358 0.034358 1[6-(6,6)] 31 -1.166429 -1.166429 -1.166429 1[6-(6,6)] 32 1.617576 1.617576 1.617576 1[6-(6,6)] 33 -2.399567 -2.399567 -2.399567 1[6-(6,6)] 34 -0.625506 -0.625506 -0.625506 1[6-(6,6)] 35 3.681758 3.681758 3.681758 1[6-(6,6)] 36 4.847088 4.847088 4.847088 1[6-(6,6)] 37 6.069482 6.069482 6.069482 1[6-(6,6)] 38 4.951355 4.951355 4.951355 1[6-(6,6)] 39 0.316557 0.316557 0.316557 1[7-(1,6,6)] 40 -0.59308 -0.59308 -0.59308 1[7-(1,6,6)] 41 1.110173 1.110173 1.110173 1[6-(1,6,7)] 42 0.598797 0.598797 0.598797 1[6-(1,6,7)] 43 -1.293256 -1.293256 -1.293256 1[6-(1,1,6)] 44 -0.092517 -0.092517 -0.092517 1[6-(1,1,6)] 45 -0.97561 -0.97561 -0.97561 1[6-(1,1,6)] 46 -2.113424 -2.113424 -2.113424 1[6-(1,6,7)] 47 -1.911832 -1.911832 -1.911832 1[6-(1,6,7)] 48 -0.617683 -0.617683 -0.617683 1[6-(1,1,6)] 49 -1.755483 -1.755483 -1.755483 1[6-(1,1,6)] 50 -0.351187 -0.351187 -0.351187 1[6-(1,1,6)] 51 5.233627 5.233627 5.233627 1[7-(1,6,6)] 52 4.323974 4.323974 4.323974 1[7-(1,6,6)] 53 6.027219 6.027219 6.027219 1[6-(1,6,7)] 54 5.515859 5.515859 5.515859 1[6-(1,6,7)] 55 3.623789 3.623789 3.623789 1[6-(1,1,6)] 56 4.824513 4.824513 4.824513 1[6-(1,1,6)] 57 3.941419 3.941419 3.941419 1[6-(1,1,6)] 58 2.803646 2.803646 2.803646 1[6-(1,6,7)] 59 3.005248 3.005248 3.005248 1[6-(1,6,7)] 60 4.299408 4.299408 4.299408 1[6-(1,1,6)] 61 3.16162 3.16162 3.16162 1[6-(1,1,6)] 62 4.565915 4.565915 4.565915 1[6-(1,1,6)] 63 4.600318 4.600318 4.600318 1[7-(1,6,6)] 64 5.509955 5.509955 5.509955 1[7-(1,6,6)] 65 3.806702 3.806702 3.806702 1[6-(1,6,7)] 66 4.318078 4.318078 4.318078 1[6-(1,6,7)] 67 6.210131 6.210131 6.210131 1[6-(1,1,6)] 68 5.009392 5.009392 5.009392 1[6-(1,1,6)] 69 5.892485 5.892485 5.892485 1[6-(1,1,6)] 70 7.030299 7.030299 7.030299 1[6-(1,6,7)] 71 6.828707 6.828707 6.828707 1[6-(1,6,7)] 72 5.534558 5.534558 5.534558 1[6-(1,1,6)] 73 6.672358 6.672358 6.672358 1[6-(1,1,6)] 74 5.268062 5.268062 5.268062 1[6-(1,1,6)] 75 -0.316753 -0.316753 -0.316753 1[7-(1,6,6)] 76 0.592901 0.592901 0.592901 1[7-(1,6,6)] 77 -1.110344 -1.110344 -1.110344 1[6-(1,6,7)] 78 -0.598984 -0.598984 -0.598984 1[6-(1,6,7)] 79 1.293086 1.293086 1.293086 1[6-(1,1,6)] 80 0.092362 0.092362 0.092362 1[6-(1,1,6)] 81 0.975456 0.975456 0.975456 1[6-(1,1,6)] 82 2.113229 2.113229 2.113229 1[6-(1,6,7)] 83 1.911627 1.911627 1.911627 1[6-(1,6,7)] 84 0.617467 0.617467 0.617467 1[6-(1,1,6)] 85 1.755255 1.755255 1.755255 1[6-(1,1,6)] 86 0.35096 0.35096 0.35096 1[6-(1,1,6)] 87 -0.572443 -0.572443 -0.572443 6[6-(6,6),8-(0),8-(27)] 88 -0.2735 -0.2735 -0.2735 6[6-(1,6),6-(1,6),6-(8,8)] 89 0.697111 0.697111 0.697111 6[1-(0),6-(1,6),6-(6,6)] 90 -0.966802 -0.966802 -0.966802 6[1-(0),6-(1,6),6-(6,6)] 91 0.126785 0.126785 0.126785 6[6-(6,6),8-(0),8-(27)] 92 1.321622 1.321622 1.321622 6[6-(1,6),6-(1,6),6-(8,8)] 93 2.424997 2.424997 2.424997 6[1-(0),6-(1,6),6-(6,6)] 94 1.358013 1.358013 1.358013 6[1-(0),6-(1,6),6-(6,6)] 95 6.296631 6.296631 6.296631 6[6-(6,6),8-(27),8-(27)] 96 5.606285 5.606285 5.606285 6[6-(1,6),6-(1,6),6-(8,8)] 97 5.656431 5.656431 5.656431 6[1-(0),6-(1,6),6-(6,6)] 98 4.967068 4.967068 4.967068 6[1-(0),6-(1,6),6-(6,6)] 99 4.245261 4.245261 4.245261 6[6-(1,6),6-(1,6),6-(8,8)] 100 4.226584 4.226584 4.226584 6[1-(0),6-(1,6),6-(6,6)] 101 4.903163 4.903163 4.903163 6[1-(0),6-(1,6),6-(6,6)] 102 3.483126 3.483126 3.483126 6[6-(6,6),8-(27),8-(27)] 103 4.34464 4.34464 4.34464 6[6-(6,6),8-(0),8-(27)] 104 4.643605 4.643605 4.643605 6[6-(1,6),6-(1,6),6-(8,8)] 105 5.614225 5.614225 5.614225 6[1-(0),6-(1,6),6-(6,6)] 106 3.950313 3.950313 3.950313 6[1-(0),6-(1,6),6-(6,6)] 107 5.043808 5.043808 5.043808 6[6-(6,6),8-(0),8-(27)] 108 6.238633 6.238633 6.238633 6[6-(1,6),6-(1,6),6-(8,8)] 109 7.342007 7.342007 7.342007 6[1-(0),6-(1,6),6-(6,6)] 110 6.275013 6.275013 6.275013 6[1-(0),6-(1,6),6-(6,6)] 111 1.379664 1.379664 1.379664 6[6-(6,6),8-(27),8-(27)] 112 0.689316 0.689316 0.689316 6[6-(1,6),6-(1,6),6-(8,8)] 113 0.739478 0.739478 0.739478 6[1-(0),6-(1,6),6-(6,6)] 114 0.050114 0.050114 0.050114 6[1-(0),6-(1,6),6-(6,6)] 115 -0.67171 -0.67171 -0.67171 6[6-(1,6),6-(1,6),6-(8,8)] 116 -0.690403 -0.690403 -0.690403 6[1-(0),6-(1,6),6-(6,6)] 117 -0.013823 -0.013823 -0.013823 6[1-(0),6-(1,6),6-(6,6)] 118 -1.433846 -1.433846 -1.433846 6[6-(6,6),8-(27),8-(27)] 119 5.489318 5.489318 5.489318 6[6-(6,6),8-(0),8-(27)] 120 5.190375 5.190375 5.190375 6[6-(1,6),6-(1,6),6-(8,8)] 121 4.219764 4.219764 4.219764 6[1-(0),6-(1,6),6-(6,6)] 122 5.883677 5.883677 5.883677 6[1-(0),6-(1,6),6-(6,6)] 123 4.79009 4.79009 4.79009 6[6-(6,6),8-(0),8-(27)] 124 3.595253 3.595253 3.595253 6[6-(1,6),6-(1,6),6-(8,8)] 125 2.491878 2.491878 2.491878 6[1-(0),6-(1,6),6-(6,6)] 126 3.558862 3.558862 3.558862 6[1-(0),6-(1,6),6-(6,6)] 127 -1.379756 -1.379756 -1.379756 6[6-(6,6),8-(27),8-(27)] 128 -0.68941 -0.68941 -0.68941 6[6-(1,6),6-(1,6),6-(8,8)] 129 -0.739556 -0.739556 -0.739556 6[1-(0),6-(1,6),6-(6,6)] 130 -0.050193 -0.050193 -0.050193 6[1-(0),6-(1,6),6-(6,6)] 131 0.671614 0.671614 0.671614 6[6-(1,6),6-(1,6),6-(8,8)] 132 0.690291 0.690291 0.690291 6[1-(0),6-(1,6),6-(6,6)] 133 0.013712 0.013712 0.013712 6[1-(0),6-(1,6),6-(6,6)] 134 1.433749 1.433749 1.433749 6[6-(6,6),8-(27),8-(27)] 135 0.572235 0.572235 0.572235 6[6-(6,6),8-(0),8-(27)] 136 0.27327 0.27327 0.27327 6[6-(1,6),6-(1,6),6-(8,8)] 137 -0.69735 -0.69735 -0.69735 6[1-(0),6-(1,6),6-(6,6)] 138 0.966562 0.966562 0.966562 6[1-(0),6-(1,6),6-(6,6)] 139 -0.126933 -0.126933 -0.126933 6[6-(6,6),8-(0),8-(27)] 140 -1.321758 -1.321758 -1.321758 6[6-(1,6),6-(1,6),6-(8,8)] 141 -2.425132 -2.425132 -2.425132 6[1-(0),6-(1,6),6-(6,6)] 142 -1.358138 -1.358138 -1.358138 6[1-(0),6-(1,6),6-(6,6)] 143 3.537211 3.537211 3.537211 6[6-(6,6),8-(27),8-(27)] 144 4.227559 4.227559 4.227559 6[6-(1,6),6-(1,6),6-(8,8)] 145 4.177397 4.177397 4.177397 6[1-(0),6-(1,6),6-(6,6)] 146 4.866761 4.866761 4.866761 6[1-(0),6-(1,6),6-(6,6)] 147 5.588585 5.588585 5.588585 6[6-(1,6),6-(1,6),6-(8,8)] 148 5.607278 5.607278 5.607278 6[1-(0),6-(1,6),6-(6,6)] 149 4.930698 4.930698 4.930698 6[1-(0),6-(1,6),6-(6,6)] 150 6.350721 6.350721 6.350721 6[6-(6,6),8-(27),8-(27)] 151 0.317549 0.317549 0.317549 6[1-(0),1-(0),6-(1,1,1),7-(1,1,6)] 152 -0.592088 -0.592088 -0.592088 6[1-(0),1-(0),1-(0),6-(1,1,7)] 153 -1.471267 -1.471267 -1.471267 6[1-(0),1-(0),6-(1,1,1),7-(1,1,6)] 154 -1.006128 -1.006128 -1.006128 6[1-(0),1-(0),1-(0),6-(1,1,7)] 155 5.234602 5.234602 5.234602 6[1-(0),1-(0),6-(1,1,1),7-(1,1,6)] 156 4.32495 4.32495 4.32495 6[1-(0),1-(0),1-(0),6-(1,1,7)] 157 3.445809 3.445809 3.445809 6[1-(0),1-(0),6-(1,1,1),7-(1,1,6)] 158 3.910967 3.910967 3.910967 6[1-(0),1-(0),1-(0),6-(1,1,7)] 159 4.599326 4.599326 4.599326 6[1-(0),1-(0),6-(1,1,1),7-(1,1,6)] 160 5.508963 5.508963 5.508963 6[1-(0),1-(0),1-(0),6-(1,1,7)] 161 6.388142 6.388142 6.388142 6[1-(0),1-(0),6-(1,1,1),7-(1,1,6)] 162 5.923003 5.923003 5.923003 6[1-(0),1-(0),1-(0),6-(1,1,7)] 163 -0.317727 -0.317727 -0.317727 6[1-(0),1-(0),6-(1,1,1),7-(1,1,6)] 164 0.591925 0.591925 0.591925 6[1-(0),1-(0),1-(0),6-(1,1,7)] 165 1.471066 1.471066 1.471066 6[1-(0),1-(0),6-(1,1,1),7-(1,1,6)] 166 1.005908 1.005908 1.005908 6[1-(0),1-(0),1-(0),6-(1,1,7)] 167 -1.42308 -1.42308 -1.42308 8[6-(6,8),27-(8,8,8)] 168 -0.048286 -0.048286 -0.048286 8[6-(6,8)] 169 -0.873333 -0.873333 -0.873333 8[6-(6,8),27-(8,8,8)] 170 0.12678 0.12678 0.12678 8[6-(6,8)] 171 -2.864731 -2.864731 -2.864731 8[6-(6,8),27-(8,8,8)] 172 6.139295 6.139295 6.139295 8[6-(6,8),27-(8,8,8)] 173 3.239235 3.239235 3.239235 8[6-(6,8),27-(8,8,8)] 174 3.132061 3.132061 3.132061 8[6-(6,8),27-(8,8,8)] 175 3.493995 3.493995 3.493995 8[6-(6,8),27-(8,8,8)] 176 4.868788 4.868788 4.868788 8[6-(6,8)] 177 4.04369 4.04369 4.04369 8[6-(6,8),27-(8,8,8)] 178 5.043813 5.043813 5.043813 8[6-(6,8)] 179 2.052317 2.052317 2.052317 8[6-(6,8),27-(8,8,8)] 180 1.222313 1.222313 1.222313 8[6-(6,8),27-(8,8,8)] 181 8.156279 8.156279 8.156279 8[6-(6,8),27-(8,8,8)] 182 -1.784928 -1.784928 -1.784928 8[6-(6,8),27-(8,8,8)] 183 6.339955 6.339955 6.339955 8[6-(6,8),27-(8,8,8)] 184 4.965161 4.965161 4.965161 8[6-(6,8)] 185 5.790208 5.790208 5.790208 8[6-(6,8),27-(8,8,8)] 186 4.790095 4.790095 4.790095 8[6-(6,8)] 187 7.781606 7.781606 7.781606 8[6-(6,8),27-(8,8,8)] 188 -1.22242 -1.22242 -1.22242 8[6-(6,8),27-(8,8,8)] 189 1.67764 1.67764 1.67764 8[6-(6,8),27-(8,8,8)] 190 1.784814 1.784814 1.784814 8[6-(6,8),27-(8,8,8)] 191 1.42288 1.42288 1.42288 8[6-(6,8),27-(8,8,8)] 192 0.048087 0.048087 0.048087 8[6-(6,8)] 193 0.873185 0.873185 0.873185 8[6-(6,8),27-(8,8,8)] 194 -0.126938 -0.126938 -0.126938 8[6-(6,8)] 195 2.864558 2.864558 2.864558 8[6-(6,8),27-(8,8,8)] 196 3.694562 3.694562 3.694562 8[6-(6,8),27-(8,8,8)] 197 -3.239404 -3.239404 -3.239404 8[6-(6,8),27-(8,8,8)] 198 6.701803 6.701803 6.701803 8[6-(6,8),27-(8,8,8)] 199 -0.315765 -0.315765 -0.315765 7[1-(0),1-(0),6-(1,1,6),6-(1,1,6)] 200 4.601298 4.601298 4.601298 7[1-(0),1-(0),6-(1,1,6),6-(1,1,6)] 201 5.23264 5.23264 5.23264 7[1-(0),1-(0),6-(1,1,6),6-(1,1,6)] 202 0.315577 0.315577 0.315577 7[1-(0),1-(0),6-(1,1,6),6-(1,1,6)]