0 mol 25 unq 0 iso 0 dist 8.94828 9.23015 5.63212 4.93826 8.40051 5.77745 8.97282 11.037 8.07318 5.23233 numMergedOcc 0
1 mol 25 unq 1 iso 0 dist 8.94828 9.23015 5.63212 4.93826 8.40051 5.77745 4.54526 4.79873 7.44277 6.29702 numMergedOcc 0
2 mol 30 unq 0 iso 0 dist 3.68549 8.3224 6.54878 6.21952 6.88974 5.14358 10.0107 10.9602 7.27243 4.61651 numMergedOcc 0
3 mol 30 unq 1 iso 0 dist 3.68549 8.3224 6.54878 6.21952 6.88974 5.14358 8.43217 10.1227 8.23784 5.34619 numMergedOcc 0
4 mol 30 unq 2 iso 0 dist 3.68549 8.3224 6.54878 5.06613 5.5814 9.83737 10.0107 10.9602 7.27243 12.0998 numMergedOcc 0
5 mol 30 unq 3 iso 0 dist 3.68549 8.3224 6.54878 5.06613 5.5814 9.83737 8.43217 10.1227 8.23784 11.789 numMergedOcc 0
6 mol 43 unq 0 iso 0 dist 8.06275 8.74209 5.41726 6.41579 8.38387 12.266 14.5833 10.0168 8.34145 16.7913 numMergedOcc 0
7 mol 109 unq 0 iso 0 dist 9.26438 6.62354 5.00433 9.97562 8.3164 9.94704 7.53887 7.07971 9.09348 8.08642 numMergedOcc 0
8 mol 109 unq 1 iso 0 dist 6.43255 8.00085 5.00433 13.5611 8.3164 9.94704 7.83378 7.07971 9.09348 8.08642 numMergedOcc 0
9 mol 122 unq 0 iso 0 dist 8.47907 6.91978 6.9791 5.08302 9.40018 10.7555 6.16219 12.6348 9.47049 10.5392 numMergedOcc 0
10 mol 122 unq 1 iso 0 dist 8.47907 6.91978 6.9791 11.2519 6.78949 13.1579 6.16219 12.6348 9.47049 15.2976 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 9.52413 8.9388 15.4336 16.5529 8.03995 19.9988 4.68208 11.3216 8.5672 16.8241 numMergedOcc 0
12 mol 186 unq 1 iso 0 dist 6.0639 8.95209 11.6282 4.40927 7.80299 12.9953 13.1688 18.0351 8.36129 15.7014 numMergedOcc 0
13 mol 186 unq 2 iso 0 dist 6.0639 8.95209 11.6282 4.40927 7.80299 12.9953 12.4508 16.7149 5.86483 15.7908 numMergedOcc 0
14 mol 195 unq 0 iso 0 dist 4.78641 6.27266 5.41635 8.94388 7.63036 10.6446 4.7754 8.9507 8.22795 10.4158 numMergedOcc 0
15 mol 206 unq 0 iso 0 dist 5.82039 9.36144 7.89575 8.60571 9.78438 8.79378 10.9033 14.3439 9.95026 9.39446 numMergedOcc 0
16 mol 206 unq 1 iso 0 dist 5.82039 9.36144 7.89575 8.60571 9.78438 8.79378 11.622 13.9709 9.09594 6.98142 numMergedOcc 0
17 mol 236 unq 0 iso 0 dist 8.95071 5.9625 10.5937 9.48296 5.66569 13.0312 4.51728 10.0129 8.93212 7.9415 numMergedOcc 0
18 mol 236 unq 1 iso 0 dist 8.95071 5.9625 10.5937 5.05085 6.11137 9.94117 4.51728 10.0129 8.93212 5.45156 numMergedOcc 0
19 mol 277 unq 0 iso 0 dist 7.151 9.22453 11.2997 12.4082 9.77689 20.2068 10.3171 9.57499 7.16209 17.8399 numMergedOcc 0
20 mol 277 unq 1 iso 0 dist 7.151 9.22453 11.2997 12.4082 9.77689 20.2068 10.6814 11.4389 4.62936 20.1297 numMergedOcc 0
21 mol 277 unq 2 iso 0 dist 7.151 9.22453 11.2997 7.47195 8.51931 10.3461 10.3171 9.57499 7.16209 6.17642 numMergedOcc 0
22 mol 277 unq 3 iso 0 dist 7.151 9.22453 11.2997 7.47195 8.51931 10.3461 10.6814 11.4389 4.62936 8.24206 numMergedOcc 0
23 mol 277 unq 4 iso 0 dist 8.53324 9.22453 4.40029 7.47195 8.96343 10.3461 10.3171 5.46926 7.16209 6.17642 numMergedOcc 0
24 mol 277 unq 5 iso 0 dist 8.53324 9.22453 4.40029 7.47195 8.96343 10.3461 10.6814 5.13913 4.62936 8.24206 numMergedOcc 0
25 mol 277 unq 6 iso 0 dist 7.23956 9.22453 3.97543 12.7088 9.29635 11.7453 10.3171 8.9682 7.16209 12.2421 numMergedOcc 0
26 mol 277 unq 7 iso 0 dist 7.23956 9.22453 3.97543 12.7088 9.29635 11.7453 10.6814 6.92711 4.62936 10.9521 numMergedOcc 0
