0 mol 6 unq 0 iso 0 dist 7.49281 7.8489 5.03987 7.13004 7.52847 11.3724 numMergedOcc 0
1 mol 6 unq 1 iso 0 dist 7.49281 9.2859 6.0648 7.13004 7.52847 12.6535 numMergedOcc 0
2 mol 6 unq 2 iso 0 dist 7.49281 6.65664 4.43277 7.13004 7.52847 4.22842 numMergedOcc 0
3 mol 18 unq 0 iso 0 dist 9.57724 4.70023 9.96814 9.74802 14.9166 5.867 numMergedOcc 0
4 mol 20 unq 0 iso 0 dist 6.18227 4.15066 3.89371 6.90375 4.5008 4.99489 numMergedOcc 0
5 mol 37 unq 0 iso 0 dist 8.87873 5.5705 4.24987 4.98218 7.01354 4.21185 numMergedOcc 0
6 mol 65 unq 0 iso 0 dist 7.72373 7.62028 4.24391 9.52322 10.8971 13.5964 numMergedOcc 0
7 mol 65 unq 1 iso 0 dist 7.72373 9.61118 13.5928 9.52322 10.8971 4.67673 numMergedOcc 0
8 mol 65 unq 2 iso 0 dist 7.72373 8.72097 12.4738 9.52322 10.8971 5.26288 numMergedOcc 0
9 mol 98 unq 0 iso 0 dist 8.96016 4.3761 12.341 7.00373 13.0095 4.45424 numMergedOcc 0
10 mol 98 unq 1 iso 0 dist 8.96016 5.84583 4.74936 7.00373 13.0095 9.47873 numMergedOcc 0
11 mol 113 unq 0 iso 0 dist 9.16474 9.04398 4.81683 7.77845 12.4092 9.89157 numMergedOcc 0
12 mol 120 unq 0 iso 0 dist 9.13604 9.63152 4.42464 7.81733 6.19595 6.10745 numMergedOcc 0
13 mol 120 unq 1 iso 0 dist 9.13604 9.05913 5.69787 7.81733 6.19595 4.6057 numMergedOcc 0
14 mol 141 unq 0 iso 0 dist 9.42321 8.55237 13.3165 8.82363 15.4277 10.089 numMergedOcc 0
15 mol 141 unq 1 iso 0 dist 6.55143 8.55237 12.6465 8.82363 12.3074 10.089 numMergedOcc 0
16 mol 141 unq 2 iso 0 dist 4.35548 8.55237 6.45623 8.82363 9.581 10.089 numMergedOcc 0
17 mol 141 unq 3 iso 0 dist 7.5024 7.80661 6.45623 5.76702 9.581 10.089 numMergedOcc 0
18 mol 147 unq 0 iso 0 dist 9.47429 8.94007 10.7363 7.88785 6.767 4.30798 numMergedOcc 0
19 mol 176 unq 0 iso 0 dist 7.06005 6.55106 4.61586 6.47176 4.54201 4.20839 numMergedOcc 0
20 mol 252 unq 0 iso 0 dist 7.51983 9.01177 15.0579 8.16932 14.6563 7.31906 numMergedOcc 0
21 mol 252 unq 1 iso 0 dist 7.51983 9.01177 15.0579 6.94065 6.84644 12.2338 numMergedOcc 0
22 mol 252 unq 2 iso 0 dist 7.51983 9.15686 5.86631 8.16932 14.6563 13.4808 numMergedOcc 0
23 mol 252 unq 3 iso 0 dist 7.51983 9.15686 5.86631 6.94065 6.84644 4.38445 numMergedOcc 0
24 mol 260 unq 0 iso 0 dist 7.69551 8.79012 9.65309 8.76664 10.2822 16.6519 numMergedOcc 0
25 mol 260 unq 1 iso 0 dist 7.69551 8.79012 9.65309 9.00987 12.6946 14.2669 numMergedOcc 0
26 mol 264 unq 0 iso 0 dist 6.14231 5.03174 3.98318 6.61098 6.08436 5.71512 numMergedOcc 0
27 mol 264 unq 1 iso 0 dist 4.68488 7.22743 3.98318 6.25794 6.08436 5.71512 numMergedOcc 0
28 mol 270 unq 0 iso 0 dist 8.36659 4.60602 4.55587 9.4555 15.1605 12.734 numMergedOcc 0
29 mol 294 unq 0 iso 0 dist 7.51626 9.09416 3.86056 8.5673 4.54735 8.2825 numMergedOcc 0
