0 mol 9 unq 0 iso 0 dist 7.70405 5.32149 3.71928 7.90063 8.01055 6.1339 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 7.70405 5.32149 3.71928 4.86477 8.61976 6.48158 numMergedOcc 0
2 mol 12 unq 0 iso 0 dist 7.68446 9.23849 5.44478 13.7296 8.15864 5.70264 numMergedOcc 0
3 mol 96 unq 0 iso 0 dist 9.51537 8.18776 9.21945 12.8263 8.9056 7.97622 numMergedOcc 0
4 mol 96 unq 1 iso 0 dist 9.51537 5.3284 5.5851 12.8263 8.9056 9.81613 numMergedOcc 0
5 mol 103 unq 0 iso 0 dist 7.95136 9.17593 5.72494 5.29804 7.66418 5.40051 numMergedOcc 0
6 mol 103 unq 1 iso 0 dist 5.8915 9.17593 8.70106 5.29804 8.078 5.40051 numMergedOcc 0
7 mol 103 unq 2 iso 0 dist 5.8915 9.17593 8.70106 8.4824 6.56481 14.0531 numMergedOcc 0
8 mol 114 unq 0 iso 0 dist 6.79014 9.85586 9.15982 5.41029 6.54778 11.2753 numMergedOcc 0
9 mol 122 unq 0 iso 0 dist 6.44313 7.34635 6.78551 10.5333 8.9864 11.7558 numMergedOcc 0
10 mol 124 unq 0 iso 0 dist 8.55572 9.01736 6.31232 5.69896 7.18976 8.28232 numMergedOcc 0
11 mol 128 unq 0 iso 0 dist 8.20904 8.39681 9.30597 12.8509 8.64054 8.54767 numMergedOcc 0
12 mol 128 unq 1 iso 0 dist 9.82711 6.33346 9.30597 6.61379 8.64054 8.54767 numMergedOcc 0
13 mol 128 unq 2 iso 0 dist 5.96435 3.7718 9.30597 6.53583 8.64054 8.54767 numMergedOcc 0
14 mol 131 unq 0 iso 0 dist 5.33659 5.18629 7.78004 5.34994 6.08846 8.73734 numMergedOcc 0
15 mol 131 unq 1 iso 0 dist 5.33659 6.53332 6.53758 5.34994 6.08846 7.28525 numMergedOcc 0
16 mol 148 unq 0 iso 0 dist 6.4413 8.90222 5.86949 9.68187 9.18753 12.2411 numMergedOcc 0
17 mol 148 unq 1 iso 0 dist 6.4413 11.3382 6.72591 9.68187 9.18753 6.76353 numMergedOcc 0
18 mol 150 unq 0 iso 0 dist 6.62609 8.93873 5.84971 9.76535 9.15244 12.1573 numMergedOcc 0
19 mol 150 unq 1 iso 0 dist 6.62609 11.5334 6.80192 9.76535 9.15244 6.65519 numMergedOcc 0
20 mol 182 unq 0 iso 0 dist 8.21538 9.53929 9.42196 6.04551 8.85111 4.60682 numMergedOcc 0
21 mol 187 unq 0 iso 0 dist 9.55621 5.27509 5.26804 9.61673 5.58167 6.31943 numMergedOcc 0
22 mol 187 unq 1 iso 0 dist 9.55621 5.27509 5.26804 12.9459 8.0501 8.33762 numMergedOcc 0
23 mol 189 unq 0 iso 0 dist 8.01521 10.5365 9.20296 9.29575 6.38294 8.18227 numMergedOcc 0
24 mol 204 unq 0 iso 0 dist 6.58174 8.01881 7.5696 10.9794 6.20044 9.55695 numMergedOcc 0
25 mol 204 unq 1 iso 0 dist 6.58174 8.01881 7.5696 9.00243 8.41232 7.67211 numMergedOcc 0
26 mol 226 unq 0 iso 0 dist 6.3687 7.95454 7.6174 4.52889 8.74399 5.92917 numMergedOcc 0
27 mol 245 unq 0 iso 0 dist 8.03294 11.3485 7.1207 8.2332 9.96585 9.95653 numMergedOcc 0
28 mol 245 unq 1 iso 0 dist 8.03294 11.3485 7.1207 9.39435 7.27022 5.00797 numMergedOcc 0
29 mol 245 unq 2 iso 0 dist 8.03294 11.3485 7.1207 15.5115 7.95061 7.10254 numMergedOcc 0
30 mol 252 unq 0 iso 0 dist 9.4344 12.7577 9.31855 7.49568 8.19645 11.2871 numMergedOcc 0
31 mol 252 unq 1 iso 0 dist 5.41885 6.85131 9.31855 6.93011 8.19645 11.2871 numMergedOcc 0
32 mol 285 unq 0 iso 0 dist 4.49395 12.8183 8.73607 9.47966 7.872 8.87977 numMergedOcc 0
33 mol 285 unq 1 iso 0 dist 4.49395 12.8183 8.73607 6.49869 6.32984 9.91326 numMergedOcc 0
