| 18 | |
| -41.6452147413000 0.400966706295295 !md1 | |
| C 0.13187120 1.84566381 0.07903661 | |
| C 1.04343851 0.80712515 0.03809859 | |
| C 0.62600337 -0.52150226 -0.03038197 | |
| C -0.71101618 -0.86446423 -0.04581426 | |
| C -1.63825333 0.17852716 0.00671112 | |
| C -1.21382302 1.50881723 0.05655732 | |
| H -1.97386151 2.27572076 0.07419410 | |
| C -3.12366731 -0.05797018 -0.02602595 | |
| O -3.89110247 0.78328313 -0.39685985 | |
| O -3.55064136 -1.25510809 0.38971269 | |
| H -2.84417269 -1.83278113 0.70821189 | |
| H -0.99350030 -1.90438837 -0.13080266 | |
| C 1.84283200 -1.36823203 -0.07410577 | |
| O 1.94506552 -2.55268543 -0.12956658 | |
| O 2.92308083 -0.51844509 -0.03022114 | |
| C 2.52731207 0.80121756 0.03808686 | |
| O 3.29760980 1.70554623 0.08656055 | |
| H 0.45935439 2.87194418 0.12181346 | |
| 18 | |
| -41.6452147067000 0.400952025753196 !md1 | |
| C 0.13204393 1.84576054 -0.07973997 | |
| C 1.04344599 0.80706915 -0.03845385 | |
| C 0.62589622 -0.52147443 0.03038973 | |
| C -0.71116345 -0.86422363 0.04586058 | |
| C -1.63823630 0.17885195 -0.00702775 | |
| C -1.21370578 1.50910493 -0.05720500 | |
| H -1.97367138 2.27610423 -0.07519256 | |
| C -3.12360014 -0.05796590 0.02624504 | |
| O -3.89115263 0.78245981 0.39875325 | |
| O -3.55033599 -1.25465335 -0.39093182 | |
| H -2.84376365 -1.83138850 -0.71086757 | |
| H -0.99393428 -1.90402591 0.13128240 | |
| C 1.84262848 -1.36828855 0.07413166 | |
| O 1.94491535 -2.55273906 0.12965372 | |
| O 2.92299804 -0.51857268 0.03088215 | |
| C 2.52738275 0.80100899 -0.03811416 | |
| O 3.29756131 1.70546326 -0.08639794 | |
| H 0.45967273 2.87197460 -0.12293088 | |
| 18 | |
| -41.6438933002000 9.904123136005916E-002 !md5 | |
| C 0.12395303 1.83487354 0.11783955 | |
| C 1.03725466 0.80174436 0.04272616 | |
| C 0.62733194 -0.53053005 -0.02562622 | |
| C -0.70844059 -0.87179245 -0.02487599 | |
| C -1.63972764 0.16931735 0.02314357 | |
| C -1.22421368 1.49956340 0.10072882 | |
| H -1.95430512 2.29337192 0.18589127 | |
| C -3.09456611 -0.21145537 0.03885197 | |
| O -3.47697663 -1.24484030 0.50445794 | |
| O -3.94587764 0.66887494 -0.50461461 | |
| H -3.50984761 1.43454611 -0.90158583 | |
| H -1.04085271 -1.89742162 -0.05924793 | |
| C 1.85308529 -1.36633415 -0.08430313 | |
| O 1.97572147 -2.54609724 -0.15688486 | |
| O 2.92739696 -0.50186605 -0.04456703 | |
| C 2.52100210 0.80993533 0.03101281 | |
| O 3.27975484 1.72541315 0.07381693 | |
| H 0.45038835 2.86020386 0.18778537 | |
| 18 | |
| -41.6438932888000 9.904003659144980E-002 !md6 | |
| C 0.12399475 1.83493223 -0.11712161 | |
| C 1.03728773 0.80178561 -0.04242668 | |
| C 0.62731802 -0.53049900 0.02561636 | |
| C -0.70845038 -0.87173817 0.02468566 | |
| C -1.63975625 0.16939438 -0.02302297 | |
| C -1.22419602 1.49964468 -0.10012740 | |
| H -1.95418992 2.29356063 -0.18511902 | |
| C -3.09454080 -0.21158254 -0.03882659 | |
| O -3.47667707 -1.24531922 -0.50392549 | |
| O -3.94621039 0.66917663 0.50350441 | |
| H -3.51018710 1.43493682 0.90032263 | |
| H -1.04090092 -1.89736548 0.05880424 | |
| C 1.85297234 -1.36635904 0.08427621 | |
| O 1.97574925 -2.54607918 0.15715813 | |
| O 2.92741434 -0.50184997 0.04420583 | |
| C 2.52109188 0.80985020 -0.03119246 | |
| O 3.27972826 1.72543046 -0.07417150 | |
| H 0.45038940 2.86029688 -0.18683955 | |