0 mol 9 unq 0 iso 0 dist 9.8978 10.4202 7.35972 11.8248 8.50424 7.32257 6.70234 10.26 5.86578 9.16444 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 6.26276 6.29049 7.35972 10.068 8.50424 7.32257 5.56616 10.26 5.86578 9.16444 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 9.32718 4.03003 6.93197 10.4427 7.23703 6.46104 7.10461 9.17684 5.63833 7.46207 numMergedOcc 0
3 mol 91 unq 0 iso 0 dist 5.51406 10.4949 8.66165 12.9007 10.1024 5.73743 18.3651 15.3154 8.07487 9.00902 numMergedOcc 0
4 mol 98 unq 0 iso 0 dist 5.94696 12.5752 6.88901 12.3884 7.06961 6.65501 17.8594 13.251 11.0132 8.05602 numMergedOcc 0
5 mol 119 unq 0 iso 0 dist 8.4733 5.73999 7.20249 6.40546 7.45148 8.99399 9.90172 8.05937 7.21894 7.85527 numMergedOcc 0
6 mol 171 unq 0 iso 0 dist 6.21194 4.47323 5.25109 11.2403 12.6853 8.24693 9.0645 13.7696 8.99392 7.13441 numMergedOcc 0
7 mol 171 unq 1 iso 0 dist 6.21194 4.73373 8.21618 11.2403 12.6853 6.71356 9.0645 13.7696 5.68701 7.13441 numMergedOcc 0
8 mol 181 unq 0 iso 0 dist 6.95568 10.453 8.86197 11.5719 8.04639 6.2479 16.8787 13.656 6.56225 8.90247 numMergedOcc 0
9 mol 181 unq 1 iso 0 dist 6.95568 10.453 8.86197 14.736 13.0409 6.22122 16.8787 13.656 6.56225 6.58792 numMergedOcc 0
10 mol 232 unq 0 iso 0 dist 9.41148 6.36084 9.78181 7.70279 6.2188 8.50102 5.18593 6.71099 7.46856 8.89211 numMergedOcc 0
11 mol 232 unq 1 iso 0 dist 7.83422 6.36084 9.8664 7.70279 12.3508 8.50102 5.18593 12.8476 7.46856 8.89211 numMergedOcc 0
12 mol 238 unq 0 iso 0 dist 7.26887 6.5335 5.92374 14.0632 8.1195 8.69104 11.7437 8.52162 6.32646 5.67917 numMergedOcc 0
13 mol 274 unq 0 iso 0 dist 9.44134 6.70266 7.75216 10.0379 11.1602 7.46394 9.82234 11.3455 4.48276 5.82876 numMergedOcc 0
14 mol 274 unq 1 iso 0 dist 9.44134 6.70266 7.75216 9.52894 5.71192 7.1729 9.82234 11.3455 4.48276 8.71129 numMergedOcc 0
