0 mol 18 unq 0 iso 0 dist 7.37356 9.2978 10.1903 10.5553 6.39243 13.725 numMergedOcc 0
1 mol 18 unq 1 iso 0 dist 7.37356 9.2978 10.1903 12.9137 9.1715 12.0482 numMergedOcc 0
2 mol 30 unq 0 iso 0 dist 3.68549 7.15015 5.5577 4.1735 7.47342 10.9555 numMergedOcc 0
3 mol 69 unq 0 iso 0 dist 6.92837 8.27307 8.99811 4.18064 7.62791 11.7488 numMergedOcc 0
4 mol 72 unq 0 iso 0 dist 5.48831 9.39178 5.82403 5.50284 6.7212 9.08821 numMergedOcc 0
5 mol 72 unq 1 iso 0 dist 9.39178 5.48831 5.82403 5.50284 9.08821 6.7212 numMergedOcc 0
6 mol 78 unq 0 iso 0 dist 9.29446 5.8992 11.5966 9.98366 5.57265 13.3461 numMergedOcc 0
7 mol 78 unq 1 iso 0 dist 9.29446 5.8992 11.5966 8.55415 7.05258 13.5194 numMergedOcc 0
8 mol 109 unq 0 iso 0 dist 7.4389 7.24527 4.98336 10.1404 8.84523 9.45397 numMergedOcc 0
9 mol 109 unq 1 iso 0 dist 7.24527 7.4389 4.98336 10.1404 9.45397 8.84523 numMergedOcc 0
10 mol 110 unq 0 iso 0 dist 9.9633 8.64633 5.00116 6.04496 9.71948 11.3434 numMergedOcc 0
11 mol 115 unq 0 iso 0 dist 8.64107 9.50575 10.4152 7.29402 6.04412 12.0631 numMergedOcc 0
12 mol 134 unq 0 iso 0 dist 8.84656 4.68975 7.11631 9.86688 7.27598 11.3191 numMergedOcc 0
13 mol 134 unq 1 iso 0 dist 8.84656 4.9155 5.00817 9.86688 7.27598 5.57904 numMergedOcc 0
14 mol 134 unq 2 iso 0 dist 4.9155 4.68975 5.79898 9.86688 5.57904 11.3191 numMergedOcc 0
15 mol 134 unq 3 iso 0 dist 4.9155 8.84656 5.00817 9.86688 5.57904 7.27598 numMergedOcc 0
16 mol 139 unq 0 iso 0 dist 5.11962 9.81432 4.94129 3.873 8.32294 12.6221 numMergedOcc 0
17 mol 154 unq 0 iso 0 dist 6.44195 7.34207 9.41666 9.05948 8.34737 15.0423 numMergedOcc 0
18 mol 172 unq 0 iso 0 dist 9.94649 7.63635 10.4836 6.78233 7.34586 12.3552 numMergedOcc 0
19 mol 172 unq 1 iso 0 dist 9.94649 7.63635 10.4836 8.65462 5.5139 12.1277 numMergedOcc 0
20 mol 229 unq 0 iso 0 dist 6.32302 6.88694 5.57838 5.75801 8.8557 5.00457 numMergedOcc 0
21 mol 229 unq 1 iso 0 dist 6.88694 6.32302 5.57838 5.75801 5.00457 8.8557 numMergedOcc 0
22 mol 258 unq 0 iso 0 dist 9.2067 9.16078 5.30627 13.5198 8.21585 10.6274 numMergedOcc 0
