0 mol 7 unq 0 iso 0 dist 9.33703 6.71084 8.60435 10.3675 6.58469 6.02702 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.33703 6.71084 8.60435 14.6139 16.4405 8.72114 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 7.38646 5.86578 6.59455 9.16444 9.87669 7.32257 numMergedOcc 0
3 mol 9 unq 1 iso 0 dist 7.38646 5.86578 6.59455 11.4615 11.4245 6.55811 numMergedOcc 0
4 mol 9 unq 2 iso 0 dist 7.38646 5.86578 6.59455 13.4922 14.7278 8.64915 numMergedOcc 0
5 mol 9 unq 3 iso 0 dist 7.38646 10.699 5.71201 11.4615 11.4245 8.48677 numMergedOcc 0
6 mol 75 unq 0 iso 0 dist 5.50645 5.78327 7.6433 8.2147 5.36954 9.81166 numMergedOcc 0
7 mol 85 unq 0 iso 0 dist 8.09408 10.2703 8.70863 13.7005 6.37974 9.82915 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 9.60416 17.0061 8.43352 12.9146 7.32662 6.7117 numMergedOcc 0
9 mol 98 unq 1 iso 0 dist 9.60416 17.0061 8.43352 14.9393 6.934 4.47349 numMergedOcc 0
10 mol 98 unq 2 iso 0 dist 9.60416 17.0061 8.43352 16.6164 7.17433 5.65185 numMergedOcc 0
11 mol 108 unq 0 iso 0 dist 7.61275 5.83671 6.12967 10.4011 9.53349 9.01852 numMergedOcc 0
12 mol 119 unq 0 iso 0 dist 7.20629 9.25614 8.8562 11.5266 4.99056 9.11344 numMergedOcc 0
13 mol 119 unq 1 iso 0 dist 7.20629 9.25614 8.8562 8.62648 3.78311 6.52773 numMergedOcc 0
14 mol 119 unq 2 iso 0 dist 7.20629 5.53673 7.91683 8.62648 3.78311 9.23858 numMergedOcc 0
15 mol 126 unq 0 iso 0 dist 9.31118 5.23583 5.94233 6.24392 5.5703 6.30546 numMergedOcc 0
16 mol 126 unq 1 iso 0 dist 9.31118 11.0459 8.56219 15.6547 9.71711 6.29233 numMergedOcc 0
17 mol 126 unq 2 iso 0 dist 8.44104 7.25449 5.94233 11.8562 5.5703 6.30546 numMergedOcc 0
18 mol 126 unq 3 iso 0 dist 8.44104 11.2199 8.56219 14.9105 9.71711 6.29233 numMergedOcc 0
19 mol 130 unq 0 iso 0 dist 7.67321 15.6039 9.13191 19.7002 13.4409 8.78276 numMergedOcc 0
20 mol 130 unq 1 iso 0 dist 7.67321 15.6039 9.13191 15.3716 9.44878 7.88805 numMergedOcc 0
21 mol 130 unq 2 iso 0 dist 7.67321 15.6039 9.13191 21.7463 14.206 7.96646 numMergedOcc 0
22 mol 130 unq 3 iso 0 dist 7.67321 15.6039 9.13191 11.7417 4.28797 7.90048 numMergedOcc 0
23 mol 130 unq 4 iso 0 dist 7.67321 8.90781 6.95405 11.7417 4.28797 9.99802 numMergedOcc 0
24 mol 152 unq 0 iso 0 dist 7.27943 5.8155 5.06613 11.6015 5.81236 6.46461 numMergedOcc 0
25 mol 181 unq 0 iso 0 dist 6.86144 5.71112 7.11785 10.1105 5.93488 9.72611 numMergedOcc 0
26 mol 209 unq 0 iso 0 dist 9.93982 5.78532 7.97418 6.14896 4.90038 6.85935 numMergedOcc 0
27 mol 209 unq 1 iso 0 dist 9.9518 5.54278 7.97418 10.795 4.90038 6.85935 numMergedOcc 0
28 mol 222 unq 0 iso 0 dist 7.11989 10.4275 9.08955 13.0107 6.42798 9.07471 numMergedOcc 0
29 mol 232 unq 0 iso 0 dist 8.73422 5.53537 6.57921 12.9697 5.8023 8.50102 numMergedOcc 0
30 mol 232 unq 1 iso 0 dist 8.73422 5.53537 6.57921 13.6896 8.25884 9.40808 numMergedOcc 0
31 mol 278 unq 0 iso 0 dist 9.67619 7.41736 7.21972 13.1685 6.54009 8.00673 numMergedOcc 0
32 mol 278 unq 1 iso 0 dist 9.67619 7.41736 7.21972 11.764 5.73336 6.62841 numMergedOcc 0
