0 mol 5 unq 0 iso 0 dist 5.14917 5.14334 9.38842 9.57274 8.88048 14.328 numMergedOcc 0
1 mol 6 unq 0 iso 0 dist 9.38351 11.1845 8.46873 13.9523 6.36157 8.89286 numMergedOcc 0
2 mol 8 unq 0 iso 0 dist 6.68091 5.37245 9.95422 4.04843 8.68949 7.19549 numMergedOcc 0
3 mol 8 unq 1 iso 0 dist 6.68091 6.66708 7.65219 4.04843 8.68949 4.77791 numMergedOcc 0
4 mol 10 unq 0 iso 0 dist 9.1125 13.4978 9.44938 4.55975 8.03458 13.5354 numMergedOcc 0
5 mol 10 unq 1 iso 0 dist 9.1125 13.4978 9.44938 11.8229 8.2106 4.82016 numMergedOcc 0
6 mol 12 unq 0 iso 0 dist 4.62913 7.57142 9.99955 4.60834 6.6051 11.9718 numMergedOcc 0
7 mol 12 unq 1 iso 0 dist 7.44542 7.57142 9.78092 4.60834 8.15864 11.9718 numMergedOcc 0
8 mol 33 unq 0 iso 0 dist 8.41842 12.6461 7.99091 10.8869 8.04019 10.4304 numMergedOcc 0
9 mol 33 unq 1 iso 0 dist 8.41842 12.6461 7.99091 10.1727 7.44828 9.147 numMergedOcc 0
10 mol 79 unq 0 iso 0 dist 8.01516 6.39793 4.52157 15.8477 8.64686 9.88522 numMergedOcc 0
11 mol 103 unq 0 iso 0 dist 6.36357 4.36597 5.24823 10.4989 6.79959 6.4251 numMergedOcc 0
12 mol 103 unq 1 iso 0 dist 5.52999 5.3449 5.24823 6.64985 6.79959 6.4251 numMergedOcc 0
13 mol 132 unq 0 iso 0 dist 7.16287 11.926 7.73306 4.21327 6.94745 8.91031 numMergedOcc 0
14 mol 133 unq 0 iso 0 dist 5.01269 6.58277 8.54607 6.65104 9.23104 7.21249 numMergedOcc 0
15 mol 133 unq 1 iso 0 dist 9.96416 10.218 7.74278 5.9683 5.79195 8.17831 numMergedOcc 0
16 mol 133 unq 2 iso 0 dist 9.96416 14.7367 8.54607 5.9683 5.79195 11.5137 numMergedOcc 0
17 mol 133 unq 3 iso 0 dist 5.9962 10.218 8.08807 5.9683 8.76088 8.17831 numMergedOcc 0
18 mol 133 unq 4 iso 0 dist 8.61448 9.64947 8.08807 13.8877 8.76088 8.17831 numMergedOcc 0
19 mol 165 unq 0 iso 0 dist 9.8446 7.28318 9.13163 4.08841 6.85551 4.81643 numMergedOcc 0
20 mol 165 unq 1 iso 0 dist 9.8446 16.8597 7.74717 4.08841 6.85551 14.2908 numMergedOcc 0
21 mol 168 unq 0 iso 0 dist 9.60268 8.67578 9.95547 9.78459 9.11481 13.7959 numMergedOcc 0
22 mol 168 unq 1 iso 0 dist 8.79954 5.21399 9.95547 9.70858 9.11481 13.7959 numMergedOcc 0
23 mol 186 unq 0 iso 0 dist 5.31333 7.05604 7.29651 4.43567 9.2254 9.89537 numMergedOcc 0
24 mol 204 unq 0 iso 0 dist 8.57123 13.5306 9.38418 7.68439 9.38188 13.9005 numMergedOcc 0
25 mol 204 unq 1 iso 0 dist 8.57123 12.4109 8.0795 7.68439 9.38188 6.98747 numMergedOcc 0
26 mol 217 unq 0 iso 0 dist 8.60259 9.79986 9.94746 6.44163 7.60302 11.2776 numMergedOcc 0
27 mol 220 unq 0 iso 0 dist 8.55805 10.4255 6.45234 4.74145 6.39087 5.9596 numMergedOcc 0
28 mol 229 unq 0 iso 0 dist 5.75755 5.17118 5.22312 3.99138 7.39596 5.39195 numMergedOcc 0
29 mol 250 unq 0 iso 0 dist 9.80833 10.7836 9.16575 9.96947 5.07895 4.24715 numMergedOcc 0
30 mol 259 unq 0 iso 0 dist 8.06908 8.77225 8.06955 5.99165 8.54422 8.52607 numMergedOcc 0
31 mol 259 unq 1 iso 0 dist 8.06908 8.77225 8.06955 4.78344 7.67473 4.55934 numMergedOcc 0
32 mol 266 unq 0 iso 0 dist 9.36806 7.61055 8.48012 4.39397 9.39714 8.68495 numMergedOcc 0
33 mol 266 unq 1 iso 0 dist 7.51446 5.01049 8.48012 9.47559 9.39714 8.68495 numMergedOcc 0
34 mol 271 unq 0 iso 0 dist 7.29764 4.63097 9.36832 4.80845 9.00071 4.85557 numMergedOcc 0
35 mol 276 unq 0 iso 0 dist 9.5388 15.2084 9.15041 17.4715 9.87655 8.99762 numMergedOcc 0
36 mol 280 unq 0 iso 0 dist 6.0218 6.77825 6.88553 4.65268 4.45141 4.68825 numMergedOcc 0
37 mol 283 unq 0 iso 0 dist 8.89292 6.32608 8.53155 4.02114 9.28067 9.90768 numMergedOcc 0
38 mol 283 unq 1 iso 0 dist 8.43009 9.5249 8.92124 4.02114 5.71075 6.69432 numMergedOcc 0
39 mol 293 unq 0 iso 0 dist 6.83404 6.89397 9.15753 5.86662 6.42608 11.0181 numMergedOcc 0
