0 mol 69 unq 0 iso 0 dist 8.23686 8.29727 10.3017 6.00694 9.29555 9.10134 numMergedOcc 0
1 mol 96 unq 0 iso 0 dist 9.39344 6.21351 11.9208 5.37184 9.48287 10.0597 numMergedOcc 0
2 mol 105 unq 0 iso 0 dist 6.37212 9.13159 7.60327 5.56565 5.30577 10.0729 numMergedOcc 0
3 mol 110 unq 0 iso 0 dist 7.85994 7.77678 8.63598 4.95967 6.5332 10.2389 numMergedOcc 0
4 mol 114 unq 0 iso 0 dist 8.85912 6.99793 11.1664 9.74115 8.14574 7.91231 numMergedOcc 0
5 mol 114 unq 1 iso 0 dist 8.85912 6.71345 4.77991 9.74115 8.14574 11.1736 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 8.61597 8.66715 13.3831 11.693 5.50699 13.0581 numMergedOcc 0
7 mol 133 unq 1 iso 0 dist 8.61597 9.00172 9.74121 11.693 5.50699 7.85025 numMergedOcc 0
8 mol 134 unq 0 iso 0 dist 8.11189 8.31276 14.5913 5.84146 7.0128 9.92467 numMergedOcc 0
9 mol 134 unq 1 iso 0 dist 8.11189 5.79157 11.9734 5.84146 7.0128 9.11672 numMergedOcc 0
10 mol 134 unq 2 iso 0 dist 8.11189 5.50687 5.57177 5.84146 7.0128 7.31419 numMergedOcc 0
11 mol 134 unq 3 iso 0 dist 8.11189 7.30919 10.8108 5.84146 7.0128 12.4741 numMergedOcc 0
12 mol 172 unq 0 iso 0 dist 6.16303 7.63635 9.23387 11.6276 9.91479 17.3786 numMergedOcc 0
13 mol 172 unq 1 iso 0 dist 6.16303 9.94649 8.10512 11.6276 9.91479 17.1876 numMergedOcc 0
14 mol 209 unq 0 iso 0 dist 8.9906 5.92907 8.42394 12.0494 8.31544 11.7243 numMergedOcc 0
15 mol 233 unq 0 iso 0 dist 8.08374 6.48196 11.2631 6.69492 6.25959 12.4566 numMergedOcc 0
16 mol 233 unq 1 iso 0 dist 8.2689 6.48196 4.80704 5.36235 5.9677 4.94074 numMergedOcc 0
17 mol 241 unq 0 iso 0 dist 9.89398 6.90245 10.8667 9.50652 8.92649 14.9966 numMergedOcc 0
18 mol 277 unq 0 iso 0 dist 4.66834 9.38793 8.31543 7.48053 5.37738 5.37894 numMergedOcc 0
