0 mol 5 unq 0 iso 0 dist 6.77563 6.93063 5.51373 5.2522 9.17088 9.89017 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 6.77563 7.86627 4.83457 5.2522 9.17088 8.73111 numMergedOcc 0
2 mol 19 unq 0 iso 0 dist 8.18518 9.47909 10.2774 9.12608 14.0749 6.16954 numMergedOcc 0
3 mol 21 unq 0 iso 0 dist 8.55122 6.55346 4.4079 5.40113 12.5635 9.89246 numMergedOcc 0
4 mol 35 unq 0 iso 0 dist 9.8985 9.03313 4.08654 11.779 9.50235 5.70699 numMergedOcc 0
5 mol 43 unq 0 iso 0 dist 9.05728 5.0553 10.871 8.43173 14.9221 7.32236 numMergedOcc 0
6 mol 68 unq 0 iso 0 dist 6.87176 8.02624 13.8724 5.48662 7.89424 7.89895 numMergedOcc 0
7 mol 68 unq 1 iso 0 dist 6.87176 9.63119 15.9935 5.48662 7.89424 9.54996 numMergedOcc 0
8 mol 68 unq 2 iso 0 dist 6.87176 7.12992 10.0669 5.48662 7.89424 7.71942 numMergedOcc 0
9 mol 68 unq 3 iso 0 dist 7.45675 8.02624 13.5622 5.48662 10.2228 7.89895 numMergedOcc 0
10 mol 68 unq 4 iso 0 dist 7.45675 9.63119 12.8986 5.48662 10.2228 9.54996 numMergedOcc 0
11 mol 68 unq 5 iso 0 dist 7.45675 7.12992 3.78133 5.48662 10.2228 7.71942 numMergedOcc 0
12 mol 152 unq 0 iso 0 dist 8.44823 5.35463 10.5856 10.0143 16.0038 9.17101 numMergedOcc 0
13 mol 154 unq 0 iso 0 dist 9.04554 8.9675 9.20471 6.12711 6.36439 9.2828 numMergedOcc 0
14 mol 162 unq 0 iso 0 dist 9.89142 7.93307 13.699 10.8288 17.9419 8.52194 numMergedOcc 0
15 mol 162 unq 1 iso 0 dist 8.06091 7.93307 4.06231 10.8288 10.932 8.52194 numMergedOcc 0
16 mol 167 unq 0 iso 0 dist 7.83781 7.78684 6.38496 4.49322 9.23645 9.50912 numMergedOcc 0
17 mol 167 unq 1 iso 0 dist 7.83781 7.78684 6.38496 5.79931 9.06133 5.74367 numMergedOcc 0
18 mol 174 unq 0 iso 0 dist 8.4931 4.97597 8.48462 9.22406 14.7488 9.79225 numMergedOcc 0
19 mol 186 unq 0 iso 0 dist 8.32829 5.88987 12.5192 4.84679 11.1127 8.11956 numMergedOcc 0
20 mol 186 unq 1 iso 0 dist 9.08672 7.62128 13.9867 13.6719 22.1873 9.44905 numMergedOcc 0
21 mol 186 unq 2 iso 0 dist 9.08672 7.62128 13.9867 10.6036 18.4234 4.95355 numMergedOcc 0
22 mol 240 unq 0 iso 0 dist 6.83069 6.40555 11.6095 6.7559 11.2013 8.46413 numMergedOcc 0
23 mol 240 unq 1 iso 0 dist 6.83069 6.40555 11.6095 9.0665 13.5043 9.95046 numMergedOcc 0
24 mol 240 unq 2 iso 0 dist 9.30995 6.40555 11.9494 6.7559 13.284 8.46413 numMergedOcc 0
25 mol 240 unq 3 iso 0 dist 9.30995 6.40555 11.9494 9.0665 15.3046 9.95046 numMergedOcc 0
26 mol 272 unq 0 iso 0 dist 8.82094 7.67597 9.75518 11.0763 12.657 8.05048 numMergedOcc 0
27 mol 272 unq 1 iso 0 dist 9.80332 9.04936 9.75518 4.4648 12.657 8.05048 numMergedOcc 0
28 mol 287 unq 0 iso 0 dist 7.45019 8.71214 7.94228 4.06566 8.19169 7.89324 numMergedOcc 0
29 mol 288 unq 0 iso 0 dist 7.45019 8.71214 7.94228 4.06566 8.19169 7.89324 numMergedOcc 0
30 mol 289 unq 0 iso 0 dist 7.45019 8.71214 7.94228 4.06566 8.19169 7.89324 numMergedOcc 0
