0 mol 25 unq 0 iso 0 dist 8.94828 4.54526 4.79873 9.23015 5.63212 7.44277 10.7149 11.9561 11.6045 7.05196 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 6.84521 6.59001 6.66407 10.8355 4.96926 8.34145 13.9129 10.5523 10.8828 6.6263 numMergedOcc 0
2 mol 43 unq 1 iso 0 dist 6.84521 6.59001 6.66407 10.8355 4.96926 8.34145 5.84171 5.73819 5.07458 6.75943 numMergedOcc 0
3 mol 56 unq 0 iso 0 dist 5.84326 11.3819 9.2898 14.3292 9.67727 8.77529 19.2135 14.5295 9.96534 9.03564 numMergedOcc 0
4 mol 109 unq 0 iso 0 dist 9.26438 7.53887 7.07971 6.62354 5.00433 9.09348 4.91393 13.1098 10.9531 9.89083 numMergedOcc 0
5 mol 109 unq 1 iso 0 dist 9.26438 7.53887 7.07971 6.62354 5.00433 9.09348 5.68669 8.69985 4.69373 8.52024 numMergedOcc 0
6 mol 109 unq 2 iso 0 dist 6.43255 7.83378 7.07971 8.00085 5.00433 9.09348 12.0697 13.1098 10.9531 9.89083 numMergedOcc 0
7 mol 109 unq 3 iso 0 dist 6.43255 7.83378 7.07971 8.00085 5.00433 9.09348 6.80429 8.69985 4.69373 8.52024 numMergedOcc 0
8 mol 109 unq 4 iso 0 dist 7.4389 10.405 7.07971 11.8878 5.00433 9.09348 18.5281 13.1098 10.9531 9.89083 numMergedOcc 0
9 mol 109 unq 5 iso 0 dist 7.4389 10.405 7.07971 11.8878 5.00433 9.09348 12.3794 8.69985 4.69373 8.52024 numMergedOcc 0
10 mol 133 unq 0 iso 0 dist 7.5055 6.30012 7.22643 10.7738 4.88025 7.48208 10.9541 8.22656 6.9945 8.26547 numMergedOcc 0
11 mol 133 unq 1 iso 0 dist 7.5055 6.30012 7.22643 10.7738 4.88025 7.48208 5.61003 6.82262 4.19723 9.05342 numMergedOcc 0
12 mol 134 unq 0 iso 0 dist 8.84656 15.9796 7.93372 14.395 10.8635 8.62504 10.879 6.37586 8.06642 9.33094 numMergedOcc 0
13 mol 134 unq 1 iso 0 dist 8.84656 15.9796 7.93372 14.395 10.8635 8.62504 16.7911 9.71307 4.00092 8.69531 numMergedOcc 0
14 mol 134 unq 2 iso 0 dist 5.79157 7.97297 8.69531 8.8437 4.00092 8.62504 11.9678 11.3835 4.46337 9.66543 numMergedOcc 0
15 mol 134 unq 3 iso 0 dist 5.79157 7.97297 8.69531 8.8437 4.00092 8.62504 13.0109 9.86662 7.41373 7.21868 numMergedOcc 0
16 mol 134 unq 4 iso 0 dist 5.79157 7.97297 8.69531 8.8437 4.00092 8.62504 14.1608 9.71307 10.8635 7.93372 numMergedOcc 0
17 mol 143 unq 0 iso 0 dist 7.73769 4.33589 5.37047 12.3347 7.39837 9.29944 7.36837 5.99315 4.78563 5.40637 numMergedOcc 0
18 mol 205 unq 0 iso 0 dist 8.57514 12.7286 6.49765 16.7486 8.97813 5.03818 15.2934 10.0042 4.3093 7.21137 numMergedOcc 0
19 mol 205 unq 1 iso 0 dist 8.57514 12.7286 6.49765 16.7486 8.97813 5.03818 18.2006 13.4269 8.90569 8.4844 numMergedOcc 0
20 mol 205 unq 2 iso 0 dist 6.11505 12.0822 6.49765 15.0907 8.97813 5.03818 15.0457 10.0042 4.3093 7.21137 numMergedOcc 0
21 mol 205 unq 3 iso 0 dist 6.11505 12.0822 6.49765 15.0907 8.97813 5.03818 18.5203 13.4269 8.90569 8.4844 numMergedOcc 0
22 mol 243 unq 0 iso 0 dist 7.80612 11.091 7.10671 12.6512 5.71505 8.20943 9.62983 8.23192 5.74165 8.69318 numMergedOcc 0
23 mol 264 unq 0 iso 0 dist 8.85887 12.6528 9.58916 10.3051 6.56539 9.78237 9.10488 12.864 11.4167 9.19754 numMergedOcc 0
24 mol 264 unq 1 iso 0 dist 8.85887 12.6528 9.58916 10.3051 6.56539 9.78237 12.4974 13.9815 13.2035 8.29262 numMergedOcc 0
25 mol 264 unq 2 iso 0 dist 6.65233 6.04707 8.29262 12.6602 13.2035 9.78237 7.11066 9.90113 5.71153 5.90924 numMergedOcc 0
26 mol 264 unq 3 iso 0 dist 6.65233 6.04707 8.29262 12.6602 13.2035 9.78237 12.9336 14.5869 12.6872 5.90058 numMergedOcc 0
27 mol 264 unq 4 iso 0 dist 6.65233 6.04707 8.29262 12.6602 13.2035 9.78237 12.4795 13.9815 6.56539 9.58916 numMergedOcc 0
