0 mol 17 unq 0 iso 0 dist 6.53817 9.81769 5.14154 10.8117 9.78331 12.567 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 5.87895 9.57974 4.87334 5.076 9.12854 13.738 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 7.45675 6.87176 10.2272 9.7068 7.26024 13.9217 numMergedOcc 0
3 mol 68 unq 1 iso 0 dist 7.45675 6.87176 10.2272 5.9436 6.36086 12.1896 numMergedOcc 0
4 mol 75 unq 0 iso 0 dist 7.118 8.24814 5.64643 9.08979 9.81166 14.6043 numMergedOcc 0
5 mol 102 unq 0 iso 0 dist 9.0361 7.48277 9.15076 13.32 8.31932 16.7818 numMergedOcc 0
6 mol 134 unq 0 iso 0 dist 7.97208 5.67862 5.00817 15.4716 7.80532 10.7586 numMergedOcc 0
7 mol 175 unq 0 iso 0 dist 9.45659 6.73365 5.35493 14.0022 9.77896 11.6765 numMergedOcc 0
8 mol 175 unq 1 iso 0 dist 9.45659 9.44856 6.80157 14.0022 9.77896 14.5689 numMergedOcc 0
9 mol 204 unq 0 iso 0 dist 7.7292 6.27396 12.5143 16.5925 9.68728 20.9634 numMergedOcc 0
10 mol 204 unq 1 iso 0 dist 6.27396 7.7292 12.5143 7.76353 9.1458 14.1279 numMergedOcc 0
11 mol 212 unq 0 iso 0 dist 7.87125 9.1384 4.12932 11.7484 9.74144 12.6219 numMergedOcc 0
12 mol 212 unq 1 iso 0 dist 7.87125 9.1384 4.12932 7.05237 8.69988 11.8495 numMergedOcc 0
13 mol 212 unq 2 iso 0 dist 7.87125 9.1384 4.12932 11.3998 8.55903 11.3832 numMergedOcc 0
14 mol 212 unq 3 iso 0 dist 7.87125 9.1384 4.12932 7.67532 7.15603 10.7294 numMergedOcc 0
15 mol 219 unq 0 iso 0 dist 8.09769 7.24832 7.02195 6.66401 7.59632 10.3776 numMergedOcc 0
16 mol 223 unq 0 iso 0 dist 9.94212 7.34316 12.3422 10.5593 7.48463 16.4299 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 8.89538 7.98022 13.0839 16.6173 8.67864 18.4434 numMergedOcc 0
18 mol 240 unq 0 iso 0 dist 6.01168 7.72928 4.28414 6.08726 6.68687 10.5594 numMergedOcc 0
19 mol 240 unq 1 iso 0 dist 6.83069 9.30995 4.28414 10.24 6.68687 10.5594 numMergedOcc 0
20 mol 274 unq 0 iso 0 dist 9.79674 8.3291 9.12834 7.28382 8.91672 12.727 numMergedOcc 0
21 mol 284 unq 0 iso 0 dist 7.2795 9.41428 5.87439 6.5455 9.33437 7.8343 numMergedOcc 0
22 mol 284 unq 1 iso 0 dist 9.41428 7.2795 5.87439 6.5455 7.8343 9.33437 numMergedOcc 0
23 mol 284 unq 2 iso 0 dist 7.35866 7.32482 5.87439 5.40432 9.33437 7.8343 numMergedOcc 0
24 mol 284 unq 3 iso 0 dist 7.32482 7.35866 5.87439 5.40432 7.8343 9.33437 numMergedOcc 0
25 mol 284 unq 4 iso 0 dist 8.08993 7.34344 13.5089 7.98227 7.8343 10.7103 numMergedOcc 0
26 mol 284 unq 5 iso 0 dist 7.34344 8.08993 13.5089 6.50962 6.78191 14.5221 numMergedOcc 0
