0 mol 7 unq 0 iso 0 dist 8.77133 6.15313 9.97624 9.5325 17.4118 8.60435 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 8.63881 7.30207 5.497 10.171 14.3325 9.5053 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 9.33901 6.30968 5.497 12.8084 14.3325 9.5053 numMergedOcc 0
3 mol 34 unq 0 iso 0 dist 9.53262 8.43904 9.33027 12.5629 7.52842 6.15801 numMergedOcc 0
4 mol 34 unq 1 iso 0 dist 9.53262 4.81608 7.32707 12.5629 7.52842 9.63403 numMergedOcc 0
5 mol 58 unq 0 iso 0 dist 9.9648 4.92118 9.11258 10.6202 9.17656 6.62229 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 6.96647 5.00474 7.10439 10.4296 11.2505 6.48232 numMergedOcc 0
7 mol 114 unq 0 iso 0 dist 9.9778 9.72019 6.13559 5.5606 6.22315 9.35942 numMergedOcc 0
8 mol 114 unq 1 iso 0 dist 9.9778 9.72019 6.13559 14.6679 13.0539 7.42482 numMergedOcc 0
9 mol 114 unq 2 iso 0 dist 6.27701 9.72019 6.51395 5.5606 6.18257 9.35942 numMergedOcc 0
10 mol 114 unq 3 iso 0 dist 6.27701 9.72019 6.51395 14.6679 10.4498 7.42482 numMergedOcc 0
11 mol 114 unq 4 iso 0 dist 6.06039 11.1547 9.83981 13.8412 8.36453 9.35942 numMergedOcc 0
12 mol 114 unq 5 iso 0 dist 6.06039 11.1547 9.83981 17.3649 17.1979 7.42482 numMergedOcc 0
13 mol 114 unq 6 iso 0 dist 9.36502 11.1547 6.13559 13.8412 6.22315 9.35942 numMergedOcc 0
14 mol 114 unq 7 iso 0 dist 9.36502 11.1547 6.13559 17.3649 13.0539 7.42482 numMergedOcc 0
15 mol 116 unq 0 iso 0 dist 9.49798 6.2875 7.35992 11.6585 7.50935 8.79367 numMergedOcc 0
16 mol 116 unq 1 iso 0 dist 8.31955 6.2875 6.49383 11.6585 12.4955 8.79367 numMergedOcc 0
17 mol 126 unq 0 iso 0 dist 8.62574 9.50242 7.36017 10.7577 5.83002 5.94233 numMergedOcc 0
18 mol 126 unq 1 iso 0 dist 8.62574 4.61044 5.14819 10.7577 5.83002 8.56219 numMergedOcc 0
19 mol 141 unq 0 iso 0 dist 6.27859 4.1584 4.25566 13.8138 11.1956 9.78667 numMergedOcc 0
20 mol 141 unq 1 iso 0 dist 6.27859 4.1584 4.25566 12.4454 9.65952 8.47026 numMergedOcc 0
21 mol 141 unq 2 iso 0 dist 6.27859 9.5453 7.31037 13.8138 11.1956 6.73983 numMergedOcc 0
22 mol 141 unq 3 iso 0 dist 6.27859 9.5453 7.31037 12.4454 9.65952 8.6387 numMergedOcc 0
23 mol 141 unq 4 iso 0 dist 6.28535 4.1584 6.63171 13.8138 14.6024 9.78667 numMergedOcc 0
24 mol 141 unq 5 iso 0 dist 6.28535 4.1584 6.63171 12.4454 11.3036 8.47026 numMergedOcc 0
25 mol 173 unq 0 iso 0 dist 9.71921 5.66096 6.64779 10.5693 10.2821 8.03528 numMergedOcc 0
26 mol 237 unq 0 iso 0 dist 6.56421 6.45163 5.98039 10.2554 9.38038 6.07878 numMergedOcc 0
27 mol 237 unq 1 iso 0 dist 6.56421 5.11844 9.48932 10.2554 9.38038 7.80422 numMergedOcc 0
