0 mol 11 unq 0 iso 0 dist 6.49709 11.1196 6.40513 4.4067 8.68293 12.8569 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 6.49709 11.1196 6.40513 13.2938 6.84216 5.83448 numMergedOcc 0
2 mol 109 unq 0 iso 0 dist 7.24527 12.7749 8.39771 4.61206 9.63963 13.188 numMergedOcc 0
3 mol 143 unq 0 iso 0 dist 7.73769 4.82452 5.30872 11.099 8.64905 7.33175 numMergedOcc 0
4 mol 163 unq 0 iso 0 dist 7.75045 11.8961 6.56115 11.5774 9.90947 6.99664 numMergedOcc 0
5 mol 163 unq 1 iso 0 dist 7.75045 11.8961 6.56115 10.9436 8.16252 4.09125 numMergedOcc 0
6 mol 167 unq 0 iso 0 dist 6.53913 10.1351 7.83781 5.60897 5.36671 8.2701 numMergedOcc 0
7 mol 206 unq 0 iso 0 dist 5.82039 7.18271 7.0119 12.4707 9.4629 6.18377 numMergedOcc 0
8 mol 210 unq 0 iso 0 dist 8.58471 10.4085 6.53736 8.19655 6.85824 10.061 numMergedOcc 0
9 mol 210 unq 1 iso 0 dist 8.58471 9.24214 8.18851 8.19655 6.85824 5.11839 numMergedOcc 0
10 mol 231 unq 0 iso 0 dist 6.02527 5.36501 9.98232 11.6594 9.9868 13.2586 numMergedOcc 0
11 mol 231 unq 1 iso 0 dist 6.02527 5.36501 9.98232 7.54254 7.3268 12.8691 numMergedOcc 0
12 mol 232 unq 0 iso 0 dist 7.57253 13.2803 7.47238 11.393 8.25985 6.89215 numMergedOcc 0
13 mol 232 unq 1 iso 0 dist 7.57253 13.2803 7.47238 7.05941 9.27788 11.652 numMergedOcc 0
14 mol 240 unq 0 iso 0 dist 7.6664 7.4587 6.01168 3.99769 5.77749 8.41875 numMergedOcc 0
15 mol 240 unq 1 iso 0 dist 7.6664 9.99502 6.83069 3.99769 5.77749 6.72226 numMergedOcc 0
16 mol 285 unq 0 iso 0 dist 9.82717 16.9394 7.66291 13.5711 6.71946 11.0066 numMergedOcc 0
17 mol 285 unq 1 iso 0 dist 9.82717 16.9394 7.66291 17.9142 8.28061 4.90871 numMergedOcc 0
18 mol 285 unq 2 iso 0 dist 9.82717 16.9394 7.66291 13.8352 5.03601 6.59144 numMergedOcc 0
19 mol 285 unq 3 iso 0 dist 8.33653 5.60271 7.66291 7.76515 6.71946 11.0066 numMergedOcc 0
20 mol 285 unq 4 iso 0 dist 8.33653 5.60271 7.66291 5.12725 8.28061 4.90871 numMergedOcc 0
21 mol 285 unq 5 iso 0 dist 8.33653 5.60271 7.66291 7.52611 5.03601 6.59144 numMergedOcc 0
22 mol 285 unq 6 iso 0 dist 6.44657 4.8011 7.66291 11.6832 6.71946 11.0066 numMergedOcc 0
23 mol 285 unq 7 iso 0 dist 6.44657 4.8011 7.66291 6.73715 8.28061 4.90871 numMergedOcc 0
24 mol 285 unq 8 iso 0 dist 6.44657 4.8011 7.66291 5.32175 5.03601 6.59144 numMergedOcc 0
