0 mol 30 unq 0 iso 0 dist 8.3224 8.15347 12.2339 10.0107 7.27243 16.7004 numMergedOcc 0
1 mol 30 unq 1 iso 0 dist 8.3224 8.15347 12.2339 8.43217 8.23784 16.1214 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 8.74209 9.72346 5.14161 14.5833 8.34145 12.2699 numMergedOcc 0
3 mol 43 unq 1 iso 0 dist 9.85555 7.45173 5.14161 14.1685 8.34145 12.2699 numMergedOcc 0
4 mol 68 unq 0 iso 0 dist 6.09085 7.51631 7.18877 10.6564 5.7369 11.7921 numMergedOcc 0
5 mol 68 unq 1 iso 0 dist 6.72469 4.9983 3.74917 3.62638 5.7369 5.64092 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 6.99586 4.55309 7.54661 10.4961 9.99441 9.68283 numMergedOcc 0
7 mol 130 unq 0 iso 0 dist 9.47287 6.90456 6.99182 9.41378 7.5573 11.9738 numMergedOcc 0
8 mol 130 unq 1 iso 0 dist 9.47287 6.90456 6.99182 7.46055 9.58633 12.0872 numMergedOcc 0
9 mol 162 unq 0 iso 0 dist 9.71155 8.7019 5.34959 4.6728 9.43904 8.91326 numMergedOcc 0
10 mol 162 unq 1 iso 0 dist 9.71155 8.7019 5.34959 7.06734 7.01095 8.33649 numMergedOcc 0
11 mol 184 unq 0 iso 0 dist 8.09403 9.98096 8.73 8.04827 4.61596 12.5326 numMergedOcc 0
12 mol 184 unq 1 iso 0 dist 8.09403 8.24035 9.71065 8.04827 4.61596 12.4197 numMergedOcc 0
13 mol 184 unq 2 iso 0 dist 8.09403 8.77932 3.30691 8.04827 4.61596 7.25623 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 9.00537 9.6283 8.85948 12.9635 8.5672 13.0128 numMergedOcc 0
15 mol 186 unq 1 iso 0 dist 8.9388 8.86574 16.2492 4.68208 8.5672 11.9226 numMergedOcc 0
16 mol 204 unq 0 iso 0 dist 7.59666 8.47283 8.03752 5.10199 9.26214 7.98864 numMergedOcc 0
17 mol 204 unq 1 iso 0 dist 6.51936 8.47283 4.05102 5.10199 5.00369 7.98864 numMergedOcc 0
18 mol 207 unq 0 iso 0 dist 7.25953 9.064 4.67727 7.22657 4.76113 7.30153 numMergedOcc 0
19 mol 214 unq 0 iso 0 dist 5.56977 6.26596 5.22858 10.4985 9.43017 14.2281 numMergedOcc 0
20 mol 214 unq 1 iso 0 dist 6.28826 7.93054 4.16963 10.996 8.25329 11.1063 numMergedOcc 0
21 mol 214 unq 2 iso 0 dist 6.28826 7.93054 4.16963 5.055 4.85332 7.66702 numMergedOcc 0
22 mol 277 unq 0 iso 0 dist 7.88009 8.70774 5.9732 5.62605 7.16209 5.13533 numMergedOcc 0
23 mol 277 unq 1 iso 0 dist 5.80061 8.70774 3.79766 5.62605 4.62936 5.13533 numMergedOcc 0
