0 mol 13 unq 0 iso 0 dist 8.12105 6.80105 10.6215 9.26072 8.96055 7.34288 numMergedOcc 0
1 mol 56 unq 0 iso 0 dist 9.06142 6.28472 7.18997 8.91502 9.93163 8.40758 numMergedOcc 0
2 mol 56 unq 1 iso 0 dist 9.06142 8.74881 10.9335 8.91502 9.93163 4.1059 numMergedOcc 0
3 mol 56 unq 2 iso 0 dist 8.41264 6.28472 8.66669 8.91502 4.5508 8.40758 numMergedOcc 0
4 mol 56 unq 3 iso 0 dist 8.41264 8.74881 7.7551 8.91502 4.5508 4.1059 numMergedOcc 0
5 mol 104 unq 0 iso 0 dist 5.71279 9.66258 9.81762 9.77713 11.6889 3.89685 numMergedOcc 0
6 mol 104 unq 1 iso 0 dist 6.18499 9.66258 7.1626 9.77713 8.4049 3.89685 numMergedOcc 0
7 mol 105 unq 0 iso 0 dist 6.11833 9.3724 6.10266 8.85561 8.22851 9.52725 numMergedOcc 0
8 mol 116 unq 0 iso 0 dist 6.90966 9.78909 6.71263 8.81935 3.75089 9.96185 numMergedOcc 0
9 mol 158 unq 0 iso 0 dist 9.38856 8.37022 11.9024 9.07685 7.67833 11.4756 numMergedOcc 0
10 mol 165 unq 0 iso 0 dist 6.85551 8.4082 10.9999 4.46402 8.22717 8.39473 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 9.2254 5.80433 11.9365 5.84716 14.6234 6.30424 numMergedOcc 0
12 mol 186 unq 1 iso 0 dist 9.2254 6.8285 13.7178 5.84716 14.6234 4.07457 numMergedOcc 0
13 mol 206 unq 0 iso 0 dist 9.42047 9.5964 8.42007 5.99766 9.82099 5.27054 numMergedOcc 0
14 mol 214 unq 0 iso 0 dist 4.36421 6.96139 10.6276 9.08316 9.70491 7.71824 numMergedOcc 0
15 mol 220 unq 0 iso 0 dist 6.39087 9.13234 7.56892 8.01243 9.77953 10.2742 numMergedOcc 0
16 mol 220 unq 1 iso 0 dist 6.39087 9.13234 7.56892 9.55264 12.8065 12.533 numMergedOcc 0
17 mol 220 unq 2 iso 0 dist 5.25149 5.00266 4.51612 6.57898 5.79012 3.91203 numMergedOcc 0
18 mol 220 unq 3 iso 0 dist 8.6368 5.00266 8.8105 6.57898 12.4207 3.91203 numMergedOcc 0
19 mol 220 unq 4 iso 0 dist 6.50756 9.49722 7.8513 9.1318 5.26215 11.2951 numMergedOcc 0
20 mol 239 unq 0 iso 0 dist 8.48545 9.51945 9.75577 7.55125 5.89242 10.0176 numMergedOcc 0
21 mol 281 unq 0 iso 0 dist 7.65321 7.82968 5.9708 5.46236 8.82508 4.91991 numMergedOcc 0
