0 mol 8 unq 0 iso 0 dist 9.52805 4.16129 6.96907 8.10061 9.08552 7.38068 numMergedOcc 0
1 mol 44 unq 0 iso 0 dist 9.06073 5.4204 8.47518 4.53848 5.87258 4.6365 numMergedOcc 0
2 mol 89 unq 0 iso 0 dist 9.01405 7.41274 6.86861 5.61553 5.10735 8.04878 numMergedOcc 0
3 mol 100 unq 0 iso 0 dist 5.72842 6.69867 8.09751 4.42177 5.30117 6.55074 numMergedOcc 0
4 mol 154 unq 0 iso 0 dist 7.16289 6.40531 4.62366 7.62658 6.91511 4.65363 numMergedOcc 0
5 mol 154 unq 1 iso 0 dist 9.3164 13.1055 4.62366 12.7211 6.91511 4.65363 numMergedOcc 0
6 mol 171 unq 0 iso 0 dist 8.63202 6.94063 4.59484 4.91613 8.09699 5.35456 numMergedOcc 0
7 mol 171 unq 1 iso 0 dist 4.46397 4.53761 4.59484 4.61696 8.09699 5.35456 numMergedOcc 0
8 mol 205 unq 0 iso 0 dist 5.70397 11.9426 8.27071 4.60102 7.84418 10.4922 numMergedOcc 0
9 mol 205 unq 1 iso 0 dist 4.67361 4.69923 8.63185 4.60102 6.92823 6.22981 numMergedOcc 0
10 mol 205 unq 2 iso 0 dist 4.67361 7.90201 7.25362 4.60102 6.92823 4.7106 numMergedOcc 0
11 mol 222 unq 0 iso 0 dist 8.27605 4.56851 5.17916 10.935 7.61739 6.4817 numMergedOcc 0
12 mol 222 unq 1 iso 0 dist 8.27605 4.56851 5.17916 11.4793 9.59191 8.05936 numMergedOcc 0
13 mol 229 unq 0 iso 0 dist 7.68999 4.44794 6.86281 9.98933 8.3932 9.72183 numMergedOcc 0
14 mol 238 unq 0 iso 0 dist 9.73405 12.7026 7.75366 9.59406 5.41453 4.70535 numMergedOcc 0
15 mol 239 unq 0 iso 0 dist 6.84692 7.26324 8.92121 4.16857 8.03092 11.1207 numMergedOcc 0
16 mol 240 unq 0 iso 0 dist 7.26496 11.2383 8.40277 3.63494 5.53403 9.62569 numMergedOcc 0
17 mol 240 unq 1 iso 0 dist 7.26496 11.2383 8.40277 9.261 9.42898 4.45525 numMergedOcc 0
18 mol 240 unq 2 iso 0 dist 7.26496 8.7212 6.50985 3.63494 5.53403 5.34658 numMergedOcc 0
19 mol 240 unq 3 iso 0 dist 7.26496 8.7212 6.50985 9.261 9.42898 8.76686 numMergedOcc 0
20 mol 279 unq 0 iso 0 dist 9.94974 10.4755 8.51994 14.2459 5.41277 7.98069 numMergedOcc 0
21 mol 279 unq 1 iso 0 dist 4.54596 9.899 8.51994 5.58851 5.41277 7.98069 numMergedOcc 0
22 mol 279 unq 2 iso 0 dist 8.32942 12.7813 8.51994 4.84196 5.41277 7.98069 numMergedOcc 0
