0 mol 4 unq 0 iso 0 dist 9.15878 10.6508 9.12428 13.0793 5.12621 8.24634 numMergedOcc 0
1 mol 4 unq 1 iso 0 dist 9.15878 10.6508 9.12428 18.9807 14.8379 9.16617 numMergedOcc 0
2 mol 4 unq 2 iso 0 dist 9.15878 10.6508 9.12428 19.3678 15.2242 8.87255 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 5.73363 10.009 6.12361 9.64933 6.76331 6.46104 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 9.76585 12.7554 8.03754 17.527 11.3298 8.95682 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 6.69184 8.59095 7.23812 17.7136 14.7042 9.24757 numMergedOcc 0
6 mol 109 unq 0 iso 0 dist 9.82647 6.78736 9.64641 13.7295 14.3991 7.02927 numMergedOcc 0
7 mol 109 unq 1 iso 0 dist 9.82647 6.78736 9.64641 9.53055 6.25986 6.60933 numMergedOcc 0
8 mol 117 unq 0 iso 0 dist 7.82249 6.7814 9.32858 12.6334 10.8848 7.70232 numMergedOcc 0
9 mol 117 unq 1 iso 0 dist 7.82249 6.7814 9.32858 10.3116 9.26317 7.4671 numMergedOcc 0
10 mol 129 unq 0 iso 0 dist 5.16531 10.0961 8.59695 12.672 7.72162 9.36851 numMergedOcc 0
11 mol 129 unq 1 iso 0 dist 5.16531 10.0961 8.59695 11.6466 7.95267 4.97175 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 5.84909 5.36939 9.1146 9.21481 15.0618 9.22232 numMergedOcc 0
13 mol 133 unq 1 iso 0 dist 5.84909 5.36939 9.1146 11.4454 9.68947 9.22661 numMergedOcc 0
14 mol 133 unq 2 iso 0 dist 5.84909 5.36939 9.1146 7.31633 5.10826 7.56378 numMergedOcc 0
15 mol 155 unq 0 iso 0 dist 8.02356 5.01007 8.57712 10.463 10.7516 6.53347 numMergedOcc 0
16 mol 156 unq 0 iso 0 dist 5.96301 5.73422 8.50926 9.54106 5.6621 9.00416 numMergedOcc 0
17 mol 163 unq 0 iso 0 dist 9.24754 4.12904 8.32426 9.62943 3.7064 9.07943 numMergedOcc 0
18 mol 170 unq 0 iso 0 dist 9.05865 7.71028 9.32245 9.53158 4.11212 6.35982 numMergedOcc 0
19 mol 170 unq 1 iso 0 dist 9.05865 7.71028 9.32245 12.7875 9.2613 7.51126 numMergedOcc 0
20 mol 181 unq 0 iso 0 dist 5.13534 4.3226 7.7544 9.46838 7.18433 9.39829 numMergedOcc 0
21 mol 195 unq 0 iso 0 dist 9.35664 8.95444 7.04524 16.7291 8.71774 9.26504 numMergedOcc 0
22 mol 205 unq 0 iso 0 dist 9.44038 13.5482 7.51951 15.4563 7.56138 5.44002 numMergedOcc 0
23 mol 205 unq 1 iso 0 dist 5.81277 4.78067 6.23932 5.86419 5.00854 4.8668 numMergedOcc 0
24 mol 205 unq 2 iso 0 dist 9.85777 4.2475 6.94789 7.23557 10.0824 4.8668 numMergedOcc 0
25 mol 205 unq 3 iso 0 dist 5.05912 4.2475 6.23932 7.23557 5.00854 4.8668 numMergedOcc 0
26 mol 205 unq 4 iso 0 dist 6.60429 6.8901 6.23932 8.86587 5.00854 4.8668 numMergedOcc 0
27 mol 210 unq 0 iso 0 dist 5.70065 3.84723 6.13878 10.7279 9.94073 7.10826 numMergedOcc 0
28 mol 271 unq 0 iso 0 dist 6.96986 8.72109 9.42899 15.4797 11.0964 9.70714 numMergedOcc 0
29 mol 274 unq 0 iso 0 dist 7.8547 4.4049 8.41236 10.4237 11.7852 7.46394 numMergedOcc 0
