0 mol 24 unq 0 iso 0 dist 7.63824 11.6096 5.9372 4.09817 9.58192 11.6859 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 7.63824 10.8208 6.93597 4.09817 9.58192 11.076 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 6.35997 4.38622 7.37118 9.9219 6.52283 10.3779 numMergedOcc 0
3 mol 79 unq 0 iso 0 dist 6.29267 6.0425 6.2576 5.22146 7.92114 4.03842 numMergedOcc 0
4 mol 79 unq 1 iso 0 dist 6.29267 6.0425 6.2576 9.79892 8.18375 3.81317 numMergedOcc 0
5 mol 79 unq 2 iso 0 dist 6.29267 11.8739 8.96069 5.22146 7.92114 10.6312 numMergedOcc 0
6 mol 79 unq 3 iso 0 dist 6.29267 11.8739 8.96069 9.79892 8.18375 4.08868 numMergedOcc 0
7 mol 79 unq 4 iso 0 dist 6.29267 11.9735 7.56495 5.22146 7.92114 9.78235 numMergedOcc 0
8 mol 79 unq 5 iso 0 dist 6.29267 11.9735 7.56495 9.79892 8.18375 6.06691 numMergedOcc 0
9 mol 85 unq 0 iso 0 dist 6.56288 14.0998 9.13593 8.175 4.29937 10.797 numMergedOcc 0
10 mol 85 unq 1 iso 0 dist 6.56288 14.0998 9.13593 9.3414 3.65628 7.04693 numMergedOcc 0
11 mol 85 unq 2 iso 0 dist 6.56288 14.0998 9.13593 14.8394 9.77774 6.7475 numMergedOcc 0
12 mol 85 unq 3 iso 0 dist 5.97559 14.0998 8.25144 8.175 5.37869 10.797 numMergedOcc 0
13 mol 85 unq 4 iso 0 dist 5.97559 14.0998 8.25144 9.3414 4.05415 7.04693 numMergedOcc 0
14 mol 85 unq 5 iso 0 dist 5.97559 14.0998 8.25144 14.8394 9.97944 6.7475 numMergedOcc 0
15 mol 93 unq 0 iso 0 dist 5.96189 6.45786 7.48947 8.99253 8.28591 14.433 numMergedOcc 0
16 mol 93 unq 1 iso 0 dist 5.96189 6.45786 7.48947 3.78587 5.35008 9.54244 numMergedOcc 0
17 mol 93 unq 2 iso 0 dist 5.96189 6.45786 7.48947 10.5386 8.30921 9.86691 numMergedOcc 0
18 mol 158 unq 0 iso 0 dist 8.24681 6.4617 4.6512 7.62254 6.77583 4.09908 numMergedOcc 0
19 mol 158 unq 1 iso 0 dist 8.24681 6.41787 9.45696 7.62254 6.77583 9.81176 numMergedOcc 0
20 mol 158 unq 2 iso 0 dist 6.51748 6.99918 4.6512 9.50276 6.77583 4.09908 numMergedOcc 0
21 mol 158 unq 3 iso 0 dist 6.51748 6.83901 9.45696 9.50276 6.77583 9.81176 numMergedOcc 0
22 mol 184 unq 0 iso 0 dist 8.73302 13.8418 7.02762 10.5797 5.23187 4.67256 numMergedOcc 0
23 mol 186 unq 0 iso 0 dist 6.91764 5.39899 5.68985 5.72704 7.36794 8.66149 numMergedOcc 0
24 mol 186 unq 1 iso 0 dist 6.91764 5.39899 5.68985 5.72963 5.81881 3.87169 numMergedOcc 0
25 mol 186 unq 2 iso 0 dist 7.00382 5.48326 8.2241 5.74741 9.4366 3.87082 numMergedOcc 0
26 mol 186 unq 3 iso 0 dist 8.78251 12.5102 5.25762 12.6481 9.34653 12.7314 numMergedOcc 0
27 mol 222 unq 0 iso 0 dist 8.7917 10.1937 9.30639 10.2527 6.39673 4.67663 numMergedOcc 0
28 mol 222 unq 1 iso 0 dist 8.7917 10.1937 9.30639 9.47138 7.80676 6.37382 numMergedOcc 0
29 mol 222 unq 2 iso 0 dist 8.7917 7.56406 6.24462 10.2527 6.39673 4.00869 numMergedOcc 0
30 mol 222 unq 3 iso 0 dist 8.7917 7.56406 6.24462 9.47138 7.80676 9.60662 numMergedOcc 0
31 mol 222 unq 4 iso 0 dist 8.7917 4.03396 6.02034 10.2527 6.39673 6.23984 numMergedOcc 0
32 mol 222 unq 5 iso 0 dist 8.7917 4.03396 6.02034 9.47138 7.80676 7.13962 numMergedOcc 0
33 mol 287 unq 0 iso 0 dist 8.4625 13.0927 9.25759 8.93497 4.93516 5.97664 numMergedOcc 0
34 mol 287 unq 1 iso 0 dist 9.03468 5.87907 9.23152 6.05528 8.06767 7.08709 numMergedOcc 0
35 mol 287 unq 2 iso 0 dist 9.03468 5.87907 9.23152 13.0121 9.91087 16.9083 numMergedOcc 0
36 mol 287 unq 3 iso 0 dist 6.05363 14.8133 9.23152 11.2805 8.06767 7.08709 numMergedOcc 0
37 mol 287 unq 4 iso 0 dist 6.05363 14.8133 9.23152 6.24038 9.91087 16.9083 numMergedOcc 0
38 mol 288 unq 0 iso 0 dist 8.4625 13.0927 9.25759 8.93497 4.93516 5.97664 numMergedOcc 0
39 mol 288 unq 1 iso 0 dist 9.03468 5.87907 9.23152 6.05528 8.06767 7.08709 numMergedOcc 0
40 mol 288 unq 2 iso 0 dist 9.03468 5.87907 9.23152 13.0121 9.91087 16.9083 numMergedOcc 0
41 mol 288 unq 3 iso 0 dist 6.05363 14.8133 9.23152 11.2805 8.06767 7.08709 numMergedOcc 0
42 mol 288 unq 4 iso 0 dist 6.05363 14.8133 9.23152 6.24038 9.91087 16.9083 numMergedOcc 0
43 mol 289 unq 0 iso 0 dist 8.4625 13.0927 9.25759 8.93497 4.93516 5.97664 numMergedOcc 0
44 mol 289 unq 1 iso 0 dist 9.03468 5.87907 9.23152 6.05528 8.06767 7.08709 numMergedOcc 0
45 mol 289 unq 2 iso 0 dist 9.03468 5.87907 9.23152 13.0121 9.91087 16.9083 numMergedOcc 0
46 mol 289 unq 3 iso 0 dist 6.05363 14.8133 9.23152 11.2805 8.06767 7.08709 numMergedOcc 0
47 mol 289 unq 4 iso 0 dist 6.05363 14.8133 9.23152 6.24038 9.91087 16.9083 numMergedOcc 0
