0 mol 33 unq 0 iso 0 dist 7.37592 8.16593 4.58881 9.67585 13.5924 12.4743 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 9.32818 4.97286 6.10527 5.39587 12.4289 9.9482 numMergedOcc 0
2 mol 34 unq 1 iso 0 dist 9.32818 4.97286 6.10527 6.47252 9.67615 3.92518 numMergedOcc 0
3 mol 39 unq 0 iso 0 dist 9.11806 8.14175 5.55405 6.17708 4.01477 7.13642 numMergedOcc 0
4 mol 39 unq 1 iso 0 dist 9.11806 6.38956 6.37241 6.17708 4.01477 5.88717 numMergedOcc 0
5 mol 68 unq 0 iso 0 dist 6.43426 5.99047 4.3044 6.72469 6.73987 6.50041 numMergedOcc 0
6 mol 78 unq 0 iso 0 dist 6.53892 6.53252 7.17043 9.6088 4.63543 11.0843 numMergedOcc 0
7 mol 141 unq 0 iso 0 dist 8.52784 6.85705 4.75097 5.05627 7.18009 3.60945 numMergedOcc 0
8 mol 141 unq 1 iso 0 dist 8.76784 6.85705 9.53666 5.05627 6.90735 3.60945 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 8.30192 5.82681 7.29037 8.9388 5.72704 11.3012 numMergedOcc 0
10 mol 193 unq 0 iso 0 dist 5.03276 7.77216 10.3389 5.06367 4.0847 6.90307 numMergedOcc 0
11 mol 217 unq 0 iso 0 dist 8.75987 9.91392 9.05793 9.41353 3.64097 7.95169 numMergedOcc 0
12 mol 217 unq 1 iso 0 dist 8.75987 9.91392 9.05793 8.28155 8.43469 10.6585 numMergedOcc 0
13 mol 229 unq 0 iso 0 dist 9.98938 7.197 7.70905 9.90415 5.41869 11.1131 numMergedOcc 0
14 mol 229 unq 1 iso 0 dist 9.98938 7.197 7.70905 6.92268 8.87669 6.70152 numMergedOcc 0
15 mol 229 unq 2 iso 0 dist 6.75338 7.06416 5.14714 5.96615 5.41869 5.66048 numMergedOcc 0
16 mol 234 unq 0 iso 0 dist 9.31001 6.99317 13.0607 8.56943 17.1006 9.82337 numMergedOcc 0
17 mol 266 unq 0 iso 0 dist 9.00434 9.17075 4.90161 7.30349 13.2055 15.4022 numMergedOcc 0
