0 mol 5 unq 0 iso 0 dist 5.14917 5.14334 9.38842 5.43606 7.15734 6.343 9.57274 8.88048 14.328 13.8842 numMergedOcc 0
1 mol 6 unq 0 iso 0 dist 9.38351 11.1845 8.46873 6.10198 6.1462 6.24927 13.9523 6.36157 8.89286 8.54844 numMergedOcc 0
2 mol 6 unq 1 iso 0 dist 9.38351 11.1845 8.46873 9.37554 9.12796 6.37317 13.9523 6.36157 8.89286 8.60722 numMergedOcc 0
3 mol 8 unq 0 iso 0 dist 6.68091 5.37245 9.95422 12.7755 9.00925 15.0835 4.04843 8.68949 7.19549 16.2669 numMergedOcc 0
4 mol 8 unq 1 iso 0 dist 6.68091 6.66708 7.65219 12.7755 9.00925 15.5539 4.04843 8.68949 4.77791 16.2669 numMergedOcc 0
5 mol 12 unq 0 iso 0 dist 4.62913 7.57142 9.99955 7.18195 5.9021 14.5243 4.60834 6.6051 11.9718 4.86727 numMergedOcc 0
6 mol 12 unq 1 iso 0 dist 4.62913 7.57142 9.99955 6.70723 8.98466 5.3482 4.60834 6.6051 11.9718 10.763 numMergedOcc 0
7 mol 79 unq 0 iso 0 dist 8.01516 6.39793 4.52157 10.5523 7.41952 5.65368 15.8477 8.64686 9.88522 9.57704 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 5.01269 6.58277 8.54607 7.25115 9.6582 7.72261 6.65104 9.23104 7.21249 12.4825 numMergedOcc 0
9 mol 133 unq 1 iso 0 dist 5.01269 6.58277 8.54607 6.02631 5.17734 4.27464 6.65104 9.23104 7.21249 7.75771 numMergedOcc 0
10 mol 133 unq 2 iso 0 dist 9.96416 10.218 7.74278 8.58899 9.07294 13.4864 5.9683 5.79195 8.17831 5.35551 numMergedOcc 0
11 mol 133 unq 3 iso 0 dist 9.96416 14.7367 8.54607 8.58899 9.07294 16.2835 5.9683 5.79195 11.5137 5.35551 numMergedOcc 0
12 mol 165 unq 0 iso 0 dist 9.8446 7.28318 9.13163 9.75412 9.59989 14.676 4.08841 6.85551 4.81643 9.94274 numMergedOcc 0
13 mol 165 unq 1 iso 0 dist 9.8446 16.8597 7.74717 9.75412 9.59989 11.997 4.08841 6.85551 14.2908 9.94274 numMergedOcc 0
14 mol 217 unq 0 iso 0 dist 8.60259 9.79986 9.94746 5.30434 6.01666 6.28311 6.44163 7.60302 11.2776 5.16489 numMergedOcc 0
15 mol 220 unq 0 iso 0 dist 8.55805 10.4255 6.45234 12.6024 7.35148 9.97963 4.74145 6.39087 5.9596 11.4142 numMergedOcc 0
16 mol 259 unq 0 iso 0 dist 8.06908 8.77225 8.06955 7.10624 8.91916 13.2664 5.99165 8.54422 8.52607 6.40534 numMergedOcc 0
17 mol 259 unq 1 iso 0 dist 8.06908 8.77225 8.06955 7.10624 8.91916 13.2664 4.78344 7.67473 4.55934 9.57286 numMergedOcc 0
18 mol 259 unq 2 iso 0 dist 8.06908 8.77225 8.06955 5.09929 4.55368 9.68677 5.99165 8.54422 8.52607 6.14631 numMergedOcc 0
19 mol 259 unq 3 iso 0 dist 8.06908 8.77225 8.06955 5.09929 4.55368 9.68677 4.78344 7.67473 4.55934 6.89689 numMergedOcc 0
20 mol 266 unq 0 iso 0 dist 9.36806 7.61055 8.48012 7.43132 8.12204 4.62446 4.39397 9.39714 8.68495 5.91091 numMergedOcc 0
21 mol 266 unq 1 iso 0 dist 7.51446 5.01049 8.48012 8.18304 8.12204 4.62446 9.47559 9.39714 8.68495 5.91091 numMergedOcc 0
22 mol 276 unq 0 iso 0 dist 9.5388 15.2084 9.15041 16.342 9.68846 12.7102 17.4715 9.87655 8.99762 4.97223 numMergedOcc 0
23 mol 283 unq 0 iso 0 dist 8.43009 9.5249 8.92124 5.51524 8.3815 5.13525 4.02114 5.71075 6.69432 4.87508 numMergedOcc 0
24 mol 283 unq 1 iso 0 dist 8.43009 9.5249 8.92124 11.6321 7.13925 8.75145 4.02114 5.71075 6.69432 7.75306 numMergedOcc 0
25 mol 293 unq 0 iso 0 dist 6.83404 6.89397 9.15753 8.01733 8.42712 6.51518 5.86662 6.42608 11.0181 8.14268 numMergedOcc 0
