0 mol 10 unq 0 iso 0 dist 5.99743 8.98746 7.60549 4.75564 6.18431 6.77807 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 5.99743 8.98746 7.60549 4.53345 9.07726 13.0204 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 8.71284 9.0665 6.59793 8.03682 8.96684 13.1928 numMergedOcc 0
3 mol 34 unq 1 iso 0 dist 8.71284 9.36493 7.83556 8.03682 8.96684 14.1216 numMergedOcc 0
4 mol 34 unq 2 iso 0 dist 8.71284 7.07773 9.10687 8.03682 8.96684 7.34832 numMergedOcc 0
5 mol 39 unq 0 iso 0 dist 9.70029 8.82943 10.7337 10.931 8.20298 16.2257 numMergedOcc 0
6 mol 39 unq 1 iso 0 dist 9.70029 8.82943 10.7337 11.4523 6.13351 15.8404 numMergedOcc 0
7 mol 73 unq 0 iso 0 dist 7.80375 9.93968 9.82442 5.56727 5.7684 11.9135 numMergedOcc 0
8 mol 141 unq 0 iso 0 dist 7.38183 4.93944 3.80763 14.7556 9.27009 10.0911 numMergedOcc 0
9 mol 154 unq 0 iso 0 dist 5.76862 6.1247 4.03185 5.32843 8.71789 9.92057 numMergedOcc 0
10 mol 154 unq 1 iso 0 dist 5.92763 6.1247 9.94519 5.32843 5.2693 9.92057 numMergedOcc 0
11 mol 181 unq 0 iso 0 dist 5.25309 8.07518 3.67187 4.9387 8.06308 11.4247 numMergedOcc 0
12 mol 181 unq 1 iso 0 dist 5.25309 7.39733 3.63671 4.9387 8.06308 10.2602 numMergedOcc 0
13 mol 184 unq 0 iso 0 dist 6.65725 9.511 4.79971 9.35176 7.81263 12.5326 numMergedOcc 0
14 mol 184 unq 1 iso 0 dist 6.65725 7.72354 5.05856 9.35176 7.81263 12.4197 numMergedOcc 0
15 mol 194 unq 0 iso 0 dist 9.819 7.26295 3.7326 11.023 4.19371 4.45769 numMergedOcc 0
16 mol 194 unq 1 iso 0 dist 9.819 7.26295 3.7326 12.3736 9.71015 8.99961 numMergedOcc 0
17 mol 194 unq 2 iso 0 dist 9.819 7.31316 7.29209 11.023 4.19371 5.89939 numMergedOcc 0
18 mol 194 unq 3 iso 0 dist 9.819 7.31316 7.29209 12.3736 9.71015 8.18853 numMergedOcc 0
19 mol 204 unq 0 iso 0 dist 6.62013 5.8294 6.52211 12.1769 9.48625 15.1924 numMergedOcc 0
20 mol 252 unq 0 iso 0 dist 9.1191 7.38867 3.99887 8.846 8.09509 9.81261 numMergedOcc 0
