0 mol 46 unq 0 iso 0 dist 8.2513 9.31319 7.32297 10.0786 9.77553 15.9435 numMergedOcc 0
1 mol 59 unq 0 iso 0 dist 8.97292 6.85083 9.49235 6.00486 6.65344 10.6564 numMergedOcc 0
2 mol 59 unq 1 iso 0 dist 6.85083 8.97292 9.49235 8.5275 7.7978 10.7681 numMergedOcc 0
3 mol 59 unq 2 iso 0 dist 6.85083 8.97292 9.49235 10.3175 9.55751 14.2522 numMergedOcc 0
4 mol 78 unq 0 iso 0 dist 6.89185 7.97217 4.62896 4.67605 9.10981 10.6287 numMergedOcc 0
5 mol 78 unq 1 iso 0 dist 7.97217 6.89185 4.62896 5.93341 9.44916 11.0261 numMergedOcc 0
6 mol 78 unq 2 iso 0 dist 7.80757 5.5849 7.19663 10.928 9.23023 13.6324 numMergedOcc 0
7 mol 78 unq 3 iso 0 dist 5.5849 7.80757 7.19663 10.1482 9.10981 13.9943 numMergedOcc 0
8 mol 112 unq 0 iso 0 dist 7.63658 7.65229 10.838 6.50047 7.53905 7.15985 numMergedOcc 0
9 mol 112 unq 1 iso 0 dist 7.65229 7.63658 10.838 6.50047 7.15985 7.53905 numMergedOcc 0
10 mol 197 unq 0 iso 0 dist 6.22696 8.12158 6.75702 6.19883 8.3337 5.41292 numMergedOcc 0
11 mol 197 unq 1 iso 0 dist 8.12158 6.22696 6.75702 6.19883 5.41292 8.3337 numMergedOcc 0
12 mol 213 unq 0 iso 0 dist 6.77104 8.10356 11.3915 12.1 7.88794 15.9329 numMergedOcc 0
13 mol 218 unq 0 iso 0 dist 5.52981 6.22077 7.83217 7.26513 8.5119 13.3259 numMergedOcc 0
14 mol 238 unq 0 iso 0 dist 9.82174 9.2521 14.0328 11.6082 6.24928 11.3074 numMergedOcc 0
15 mol 238 unq 1 iso 0 dist 9.82174 8.51359 15.8898 11.6082 6.24928 14.244 numMergedOcc 0
16 mol 249 unq 0 iso 0 dist 6.42827 6.93507 8.34718 7.26569 6.37672 12.8391 numMergedOcc 0
17 mol 249 unq 1 iso 0 dist 6.42827 6.93507 8.34718 6.09915 8.94023 12.9036 numMergedOcc 0
18 mol 259 unq 0 iso 0 dist 6.49599 9.34738 4.86771 11.5386 8.06771 12.3795 numMergedOcc 0
19 mol 259 unq 1 iso 0 dist 6.49599 9.47382 6.96053 11.5386 8.06771 11.1503 numMergedOcc 0
20 mol 259 unq 2 iso 0 dist 9.47382 6.49599 6.96053 12.8939 9.54857 14.0139 numMergedOcc 0
21 mol 259 unq 3 iso 0 dist 9.47382 9.34738 7.64658 12.8939 9.54857 16.6234 numMergedOcc 0
22 mol 271 unq 0 iso 0 dist 5.98336 9.04738 10.2122 5.17979 9.36832 12.6904 numMergedOcc 0
23 mol 271 unq 1 iso 0 dist 5.98336 8.68046 6.8467 5.17979 9.36832 13.7192 numMergedOcc 0
24 mol 271 unq 2 iso 0 dist 5.98336 9.67453 10.5503 5.17979 9.36832 12.1522 numMergedOcc 0
25 mol 272 unq 0 iso 0 dist 7.22438 7.66615 5.40809 7.51377 9.96394 13.3211 numMergedOcc 0
