0 mol 0 unq 0 iso 0 dist 6.99594 5.66453 7.48645 7.31837 6.0597 6.64713 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 9.86938 11.4765 8.94096 16.4487 12.7056 8.77457 numMergedOcc 0
2 mol 8 unq 1 iso 0 dist 8.16743 12.3138 9.07858 20.0755 16.8602 8.77457 numMergedOcc 0
3 mol 9 unq 0 iso 0 dist 8.77049 5.3866 9.82483 9.8978 6.0397 8.076 numMergedOcc 0
4 mol 9 unq 1 iso 0 dist 6.95341 6.49896 9.82483 6.26276 6.0397 8.076 numMergedOcc 0
5 mol 13 unq 0 iso 0 dist 9.37413 10.8881 8.00865 17.416 15.907 7.98679 numMergedOcc 0
6 mol 13 unq 1 iso 0 dist 9.18487 10.8881 9.11447 17.416 15.0129 7.98679 numMergedOcc 0
7 mol 44 unq 0 iso 0 dist 7.23261 8.17152 9.17518 12.7039 9.05795 7.03307 numMergedOcc 0
8 mol 44 unq 1 iso 0 dist 7.23261 8.17152 9.17518 10.8505 6.37181 7.25707 numMergedOcc 0
9 mol 44 unq 2 iso 0 dist 6.20069 8.17152 8.21833 12.7039 11.814 7.03307 numMergedOcc 0
10 mol 44 unq 3 iso 0 dist 6.20069 8.17152 8.21833 10.8505 7.77924 7.25707 numMergedOcc 0
11 mol 44 unq 4 iso 0 dist 8.96501 10.0357 9.17518 13.31 9.05795 7.03307 numMergedOcc 0
12 mol 44 unq 5 iso 0 dist 8.96501 10.0357 9.17518 13.2328 6.37181 7.25707 numMergedOcc 0
13 mol 44 unq 6 iso 0 dist 9.4798 7.37043 9.17518 10.53 9.05795 7.03307 numMergedOcc 0
14 mol 44 unq 7 iso 0 dist 9.4798 7.37043 9.17518 11.7913 6.37181 7.25707 numMergedOcc 0
15 mol 52 unq 0 iso 0 dist 8.6668 5.45185 8.65019 11.2668 4.70551 9.80143 numMergedOcc 0
16 mol 56 unq 0 iso 0 dist 5.67098 7.39536 5.86571 10.1056 6.56778 6.99108 numMergedOcc 0
17 mol 56 unq 1 iso 0 dist 8.58218 11.4735 5.86571 14.0226 6.56778 6.99108 numMergedOcc 0
18 mol 90 unq 0 iso 0 dist 9.30724 13.8613 7.54496 13.7463 4.48233 7.31784 numMergedOcc 0
19 mol 114 unq 0 iso 0 dist 7.50886 7.3539 8.11094 12.4185 6.76585 9.17466 numMergedOcc 0
20 mol 154 unq 0 iso 0 dist 8.46844 6.14702 6.28417 11.4264 4.70993 6.51014 numMergedOcc 0
21 mol 163 unq 0 iso 0 dist 8.70104 3.64474 8.21476 13.1944 15.4471 9.79069 numMergedOcc 0
22 mol 163 unq 1 iso 0 dist 8.70104 3.64474 8.21476 9.86052 9.33755 9.27496 numMergedOcc 0
23 mol 181 unq 0 iso 0 dist 9.70025 8.93412 7.96291 14.9536 9.08227 9.26796 numMergedOcc 0
24 mol 218 unq 0 iso 0 dist 8.27907 5.77167 6.86795 11.2005 5.89482 8.3087 numMergedOcc 0
25 mol 218 unq 1 iso 0 dist 7.90156 12.2629 6.61099 14.4578 6.65167 8.3087 numMergedOcc 0
26 mol 243 unq 0 iso 0 dist 8.53888 4.2759 6.01071 8.55613 4.78857 7.44706 numMergedOcc 0
27 mol 243 unq 1 iso 0 dist 9.46855 5.81296 6.01071 12.3886 4.78857 7.44706 numMergedOcc 0
28 mol 248 unq 0 iso 0 dist 8.97536 5.82647 8.42446 12.7636 9.5697 7.97135 numMergedOcc 0
29 mol 277 unq 0 iso 0 dist 8.96092 9.93007 7.25677 10.1675 6.56697 7.85414 numMergedOcc 0
30 mol 277 unq 1 iso 0 dist 8.96092 11.01 6.73126 17.5154 9.00644 8.81717 numMergedOcc 0
31 mol 278 unq 0 iso 0 dist 8.56029 10.046 9.80746 13.8825 11.3687 7.21972 numMergedOcc 0
32 mol 285 unq 0 iso 0 dist 8.85005 3.60708 5.80415 8.60489 7.87216 8.16947 numMergedOcc 0
33 mol 285 unq 1 iso 0 dist 8.85005 3.60708 5.80415 8.76332 4.39689 6.74142 numMergedOcc 0
34 mol 285 unq 2 iso 0 dist 8.96754 12.0894 5.80415 16.2666 7.87216 8.16947 numMergedOcc 0
35 mol 285 unq 3 iso 0 dist 8.96754 12.0894 5.80415 13.1934 4.39689 6.74142 numMergedOcc 0
