0 mol 12 unq 0 iso 0 dist 5.25583 6.7002 9.75368 6.62201 8.18139 8.10227 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 8.54999 6.56834 9.21978 9.81268 6.57633 6.43237 numMergedOcc 0
2 mol 43 unq 1 iso 0 dist 8.54999 14.3492 8.03754 9.81268 6.57633 8.6477 numMergedOcc 0
3 mol 64 unq 0 iso 0 dist 7.85826 6.51043 9.15386 4.08338 7.11238 5.49106 numMergedOcc 0
4 mol 66 unq 0 iso 0 dist 7.16147 10.0871 7.3359 7.28551 8.65033 7.69664 numMergedOcc 0
5 mol 66 unq 1 iso 0 dist 7.16147 10.0871 7.3359 3.96299 7.8807 8.09941 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 8.93939 6.34076 9.41049 16.7919 9.79061 15.6317 numMergedOcc 0
7 mol 79 unq 0 iso 0 dist 6.00684 4.98967 8.0139 5.22146 8.4416 5.80367 numMergedOcc 0
8 mol 79 unq 1 iso 0 dist 6.00684 4.98967 8.0139 9.79892 7.79538 10.1442 numMergedOcc 0
9 mol 158 unq 0 iso 0 dist 6.33118 7.85912 9.99005 3.51425 7.68074 10.115 numMergedOcc 0
10 mol 158 unq 1 iso 0 dist 6.33118 7.85912 9.99005 11.7855 9.1854 17.6575 numMergedOcc 0
11 mol 206 unq 0 iso 0 dist 8.37024 10.9584 8.45825 4.05534 8.43994 12.3129 numMergedOcc 0
12 mol 217 unq 0 iso 0 dist 6.10085 7.93016 6.23025 3.64097 7.00456 5.60586 numMergedOcc 0
13 mol 217 unq 1 iso 0 dist 6.10085 7.93016 6.23025 8.43469 8.99484 4.64118 numMergedOcc 0
14 mol 236 unq 0 iso 0 dist 7.61854 5.03598 5.90804 14.3613 8.75172 10.5937 numMergedOcc 0
15 mol 243 unq 0 iso 0 dist 8.82741 9.30844 9.35819 3.98086 8.89434 5.62653 numMergedOcc 0
16 mol 243 unq 1 iso 0 dist 4.88105 9.73641 9.35819 6.95692 8.89434 5.62653 numMergedOcc 0
17 mol 243 unq 2 iso 0 dist 9.44057 14.3806 9.35819 12.5972 8.89434 5.62653 numMergedOcc 0
