0 mol 1 unq 0 iso 0 dist 5.87976 8.83387 4.93091 7.58747 7.81034 9.21329 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 5.87976 8.83387 4.93091 6.38325 9.19497 8.54277 numMergedOcc 0
2 mol 1 unq 2 iso 0 dist 8.71167 9.85305 4.93091 10.2917 7.81034 9.21329 numMergedOcc 0
3 mol 1 unq 3 iso 0 dist 8.71167 9.85305 4.93091 4.69498 9.19497 8.54277 numMergedOcc 0
4 mol 2 unq 0 iso 0 dist 5.69072 7.60935 6.93149 4.69809 6.47123 10.1733 numMergedOcc 0
5 mol 17 unq 0 iso 0 dist 6.84727 8.44037 5.09467 4.88828 6.3896 8.90155 numMergedOcc 0
6 mol 26 unq 0 iso 0 dist 5.51158 8.63439 4.10415 6.69874 5.73363 9.54171 numMergedOcc 0
7 mol 46 unq 0 iso 0 dist 7.19406 7.12713 9.83606 9.72598 8.18251 11.6889 numMergedOcc 0
8 mol 46 unq 1 iso 0 dist 7.19406 7.12713 9.83606 4.50032 5.02642 7.44805 numMergedOcc 0
9 mol 48 unq 0 iso 0 dist 7.55854 9.29102 3.60325 5.37112 9.14072 11.0811 numMergedOcc 0
10 mol 48 unq 1 iso 0 dist 5.48669 8.30446 3.60325 8.94459 9.14072 11.0811 numMergedOcc 0
11 mol 65 unq 0 iso 0 dist 7.62028 9.42411 9.27421 5.42391 5.98248 11.4008 numMergedOcc 0
12 mol 76 unq 0 iso 0 dist 8.99618 6.45955 9.93156 7.79139 7.5434 12.7581 numMergedOcc 0
13 mol 76 unq 1 iso 0 dist 9.0101 8.26805 9.68005 4.77004 7.41861 9.50939 numMergedOcc 0
14 mol 76 unq 2 iso 0 dist 9.0101 9.68577 14.6547 4.77004 7.41861 13.4154 numMergedOcc 0
15 mol 114 unq 0 iso 0 dist 5.99873 8.18193 6.83136 5.64342 8.79677 5.87382 numMergedOcc 0
16 mol 114 unq 1 iso 0 dist 6.8456 8.18356 5.40104 4.65951 5.82456 9.35759 numMergedOcc 0
17 mol 171 unq 0 iso 0 dist 9.43988 6.80203 5.58661 6.94063 9.1056 8.82481 numMergedOcc 0
18 mol 185 unq 0 iso 0 dist 8.86187 9.62449 3.15736 7.48754 8.83768 10.1603 numMergedOcc 0
19 mol 185 unq 1 iso 0 dist 9.27825 9.62449 5.80135 9.44002 8.85182 9.44685 numMergedOcc 0
20 mol 185 unq 2 iso 0 dist 9.27825 9.62449 5.80135 7.48754 5.7065 10.1603 numMergedOcc 0
21 mol 266 unq 0 iso 0 dist 9.477 6.9943 3.87565 4.47412 9.80006 9.03341 numMergedOcc 0
22 mol 266 unq 1 iso 0 dist 9.477 7.36685 9.25882 4.47412 9.80006 10.9833 numMergedOcc 0
23 mol 266 unq 2 iso 0 dist 9.477 9.03099 12.1357 4.47412 9.80006 12.7605 numMergedOcc 0
