0 mol 7 unq 0 iso 0 dist 6.64176 6.70503 5.99972 7.6899 9.68006 5.13353 8.80895 4.60206 5.51421 7.81271 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 6.64176 7.6899 9.68006 6.70503 5.99972 5.13353 8.80895 4.60206 7.81271 5.51421 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 6.02731 4.05764 4.74544 11.4221 7.56205 8.62608 4.85282 7.46975 8.1599 14.3699 numMergedOcc 0
3 mol 65 unq 0 iso 0 dist 8.70783 10.8737 6.72639 9.96191 6.76508 5.48814 7.62028 6.59475 8.76461 11.2698 numMergedOcc 0
4 mol 181 unq 0 iso 0 dist 9.89987 5.10258 6.22122 7.89844 6.2479 6.01247 13.1737 12.0718 9.58911 9.86845 numMergedOcc 0
5 mol 181 unq 1 iso 0 dist 9.89987 5.10258 6.22122 16.1714 7.99195 12.6324 13.1737 12.0718 9.58911 13.0329 numMergedOcc 0
6 mol 196 unq 0 iso 0 dist 4.83135 9.99132 6.86319 6.85258 6.70531 10.2747 15.5979 11.4857 8.79558 17.0839 numMergedOcc 0
7 mol 232 unq 0 iso 0 dist 8.70651 9.88635 8.50102 5.08111 9.40808 6.56633 8.15743 6.36084 7.70279 9.29752 numMergedOcc 0
8 mol 232 unq 1 iso 0 dist 8.70651 5.08111 9.40808 9.88635 8.50102 6.56633 8.15743 6.36084 9.29752 7.70279 numMergedOcc 0
9 mol 238 unq 0 iso 0 dist 6.38654 6.89249 8.94014 9.42382 7.02333 5.6348 14.4186 16.2294 9.32451 11.5933 numMergedOcc 0
10 mol 238 unq 1 iso 0 dist 6.38654 6.89249 8.94014 11.5722 8.67864 8.87326 14.4186 16.2294 9.32451 10.7555 numMergedOcc 0
11 mol 238 unq 2 iso 0 dist 9.77185 9.71057 8.94014 4.39154 7.02333 5.6348 14.1871 16.2294 9.32451 11.5933 numMergedOcc 0
12 mol 238 unq 3 iso 0 dist 9.77185 9.71057 8.94014 6.77956 8.67864 8.87326 14.1871 16.2294 9.32451 10.7555 numMergedOcc 0
13 mol 243 unq 0 iso 0 dist 7.24253 6.54531 7.49645 11.6229 9.9222 5.37618 5.1766 3.87679 6.86162 10.0226 numMergedOcc 0
14 mol 258 unq 0 iso 0 dist 7.41653 6.88723 9.63959 7.08073 9.96262 12.4198 10.577 5.32742 9.59174 14.8786 numMergedOcc 0
15 mol 258 unq 1 iso 0 dist 7.41653 6.88723 9.63959 11.7129 7.21311 12.321 10.577 5.32742 9.59174 9.98141 numMergedOcc 0
16 mol 259 unq 0 iso 0 dist 9.98231 6.00315 7.98231 5.69584 7.08526 6.96053 12.6191 5.61261 8.06771 11.1503 numMergedOcc 0
17 mol 259 unq 1 iso 0 dist 9.98231 5.69584 7.08526 6.00315 7.98231 6.96053 11.678 8.74892 9.54857 14.0139 numMergedOcc 0
