0 mol 7 unq 0 iso 0 dist 8.41585 9.68596 14.7759 9.87885 12.8323 10.1841 10.2446 7.88043 11.024 8.15894 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.41585 9.68596 14.7759 9.87885 12.8323 10.1841 12.3097 8.80762 15.0497 8.45544 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 8.86116 8.60554 8.52463 8.09311 11.6226 15.4445 5.97304 6.60423 9.36461 10.8583 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 8.86116 8.60554 8.52463 9.05357 13.1949 11.8971 5.97304 6.60423 9.36461 14.2818 numMergedOcc 0
4 mol 24 unq 2 iso 0 dist 8.86116 8.44664 10.971 8.09311 11.6226 3.84336 5.97304 6.60423 11.9865 10.8583 numMergedOcc 0
5 mol 24 unq 3 iso 0 dist 8.86116 8.44664 10.971 9.05357 13.1949 7.01276 5.97304 6.60423 11.9865 14.2818 numMergedOcc 0
6 mol 24 unq 4 iso 0 dist 8.86116 9.44691 13.4893 8.09311 11.6226 13.0295 5.97304 6.60423 14.4545 10.8583 numMergedOcc 0
7 mol 24 unq 5 iso 0 dist 8.86116 9.44691 13.4893 9.05357 13.1949 4.02219 5.97304 6.60423 14.4545 14.2818 numMergedOcc 0
8 mol 24 unq 6 iso 0 dist 8.86116 9.41441 14.012 7.95042 5.11636 10.0453 6.58998 6.72502 11.5841 8.24948 numMergedOcc 0
9 mol 25 unq 0 iso 0 dist 5.04899 8.87757 5.77929 7.05196 6.47509 3.904 9.20601 6.6492 11.4352 12.8378 numMergedOcc 0
10 mol 25 unq 1 iso 0 dist 6.03987 6.85556 5.68392 7.99919 4.77954 6.19011 8.4666 5.81959 11.3646 8.52777 numMergedOcc 0
11 mol 85 unq 0 iso 0 dist 7.95579 7.54568 10.2865 7.7068 6.36397 4.93735 5.08358 8.00777 12.1999 10.7316 numMergedOcc 0
12 mol 85 unq 1 iso 0 dist 6.19965 7.54568 8.09967 7.7068 4.41789 4.93735 5.08358 7.1589 12.1999 10.7316 numMergedOcc 0
13 mol 98 unq 0 iso 0 dist 5.08437 6.7117 7.06961 5.10496 3.9764 3.94967 7.32662 7.26086 8.43352 8.75597 numMergedOcc 0
14 mol 98 unq 1 iso 0 dist 6.10456 4.47349 7.06961 7.54889 10.4782 3.92737 6.934 7.26086 8.43352 12.2279 numMergedOcc 0
15 mol 98 unq 2 iso 0 dist 6.10456 4.47349 7.06961 5.2571 3.9764 3.94967 6.934 7.26086 8.43352 8.75597 numMergedOcc 0
16 mol 119 unq 0 iso 0 dist 8.73993 6.52773 7.20179 7.64052 9.68677 5.37917 3.78311 7.77116 8.8562 9.57341 numMergedOcc 0
17 mol 119 unq 1 iso 0 dist 8.73993 9.23858 9.89358 7.64052 9.68677 15.7711 3.78311 7.77116 7.91683 9.57341 numMergedOcc 0
18 mol 134 unq 0 iso 0 dist 8.94367 6.23142 4.57832 9.33094 7.41373 6.93712 9.4027 8.20836 9.30061 5.11043 numMergedOcc 0
19 mol 134 unq 1 iso 0 dist 6.49416 6.23142 5.71679 9.33094 12.3479 6.93712 8.46636 5.53031 10.0154 15.5709 numMergedOcc 0
20 mol 134 unq 2 iso 0 dist 9.86662 9.94764 4.57832 9.1998 12.8086 11.5269 5.12325 8.20836 9.30061 6.99345 numMergedOcc 0
21 mol 134 unq 3 iso 0 dist 9.86662 9.94764 4.57832 8.69531 7.41373 6.93712 5.12325 8.20836 9.30061 5.11043 numMergedOcc 0
22 mol 175 unq 0 iso 0 dist 9.29945 9.39352 7.27408 9.63417 11.0361 6.43397 4.24624 8.0154 9.71028 12.349 numMergedOcc 0
23 mol 181 unq 0 iso 0 dist 9.1374 6.2479 6.6251 9.76212 12.9532 6.39406 13.8722 6.51749 10.8541 16.2165 numMergedOcc 0
24 mol 205 unq 0 iso 0 dist 6.03031 6.03688 8.15057 6.52816 9.49403 5.28417 5.28092 8.44861 11.2584 10.183 numMergedOcc 0
25 mol 205 unq 1 iso 0 dist 7.26832 6.03688 12.4957 6.52816 13.514 5.28417 5.28092 5.60393 11.2584 10.183 numMergedOcc 0
26 mol 222 unq 0 iso 0 dist 6.00706 9.07471 7.75466 6.74196 8.84507 4.67663 6.42798 7.862 9.08955 7.97027 numMergedOcc 0
27 mol 222 unq 1 iso 0 dist 6.00706 9.07471 7.75466 8.36842 6.02502 6.37382 6.42798 7.862 9.08955 4.9876 numMergedOcc 0
28 mol 222 unq 2 iso 0 dist 6.00706 9.07471 7.75466 9.75472 5.18677 6.31322 6.42798 7.862 9.08955 8.23353 numMergedOcc 0
