0 mol 25 unq 0 iso 0 dist 8.94828 14.2406 7.57578 4.54526 4.79873 10.2864 9.23015 5.63212 10.9703 7.44277 numMergedOcc 0
1 mol 25 unq 1 iso 0 dist 8.94828 15.6642 7.17969 4.54526 4.79873 11.4148 9.23015 5.63212 10.3338 7.44277 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 6.84521 5.84171 5.73819 6.59001 6.66407 5.07458 13.8606 11.4153 13.8936 9.50614 numMergedOcc 0
3 mol 43 unq 1 iso 0 dist 6.84521 5.84171 5.73819 6.59001 6.66407 5.07458 10.8355 4.96926 6.75943 8.34145 numMergedOcc 0
4 mol 109 unq 0 iso 0 dist 9.26438 5.68669 8.69985 7.53887 7.07971 4.69373 6.62354 5.00433 8.52024 9.09348 numMergedOcc 0
5 mol 109 unq 1 iso 0 dist 6.43255 6.80429 8.69985 7.83378 7.07971 4.69373 8.00085 5.00433 8.52024 9.09348 numMergedOcc 0
6 mol 109 unq 2 iso 0 dist 7.4389 12.3794 8.69985 10.405 7.07971 4.69373 11.8878 5.00433 8.52024 9.09348 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 7.5055 10.9541 8.22656 6.30012 7.22643 6.9945 10.7738 4.88025 8.26547 7.48208 numMergedOcc 0
8 mol 133 unq 1 iso 0 dist 7.5055 5.61003 6.82262 6.30012 7.22643 4.19723 10.7738 4.88025 9.05342 7.48208 numMergedOcc 0
9 mol 134 unq 0 iso 0 dist 8.84656 10.879 6.37586 15.9796 7.93372 8.06642 14.395 10.8635 9.33094 8.62504 numMergedOcc 0
10 mol 134 unq 1 iso 0 dist 8.84656 16.7911 9.71307 15.9796 7.93372 4.00092 14.395 10.8635 8.69531 8.62504 numMergedOcc 0
11 mol 134 unq 2 iso 0 dist 5.79157 13.0109 9.86662 7.97297 8.69531 7.41373 8.8437 4.00092 7.21868 8.62504 numMergedOcc 0
12 mol 134 unq 3 iso 0 dist 5.79157 14.1608 9.71307 7.97297 8.69531 10.8635 8.8437 4.00092 7.93372 8.62504 numMergedOcc 0
13 mol 143 unq 0 iso 0 dist 7.73769 7.36837 5.99315 4.33589 5.37047 4.78563 12.3347 7.39837 5.40637 9.29944 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 8.77347 6.05728 7.54065 8.69152 6.61112 11.0961 16.8979 10.8286 17.8564 8.5672 numMergedOcc 0
15 mol 205 unq 0 iso 0 dist 8.57514 5.56395 9.61492 12.7286 6.49765 10.6504 16.7486 8.97813 15.255 5.03818 numMergedOcc 0
16 mol 205 unq 1 iso 0 dist 8.57514 12.397 7.45763 12.7286 6.49765 8.67921 16.7486 8.97813 8.95122 5.03818 numMergedOcc 0
17 mol 205 unq 2 iso 0 dist 6.11505 9.35174 9.61492 12.0822 6.49765 10.6504 15.0907 8.97813 15.255 5.03818 numMergedOcc 0
18 mol 205 unq 3 iso 0 dist 6.11505 11.3225 7.45763 12.0822 6.49765 8.67921 15.0907 8.97813 8.95122 5.03818 numMergedOcc 0
19 mol 243 unq 0 iso 0 dist 7.80612 9.62983 8.23192 11.091 7.10671 5.74165 12.6512 5.71505 8.69318 8.20943 numMergedOcc 0
20 mol 264 unq 0 iso 0 dist 6.65233 7.78423 9.17653 6.04707 8.29262 10.7813 12.6602 13.2035 19.5824 9.78237 numMergedOcc 0
21 mol 277 unq 0 iso 0 dist 7.23956 15.6875 9.7748 10.3171 8.9682 17.6038 9.22453 3.97543 12.1398 7.16209 numMergedOcc 0
22 mol 277 unq 1 iso 0 dist 7.23956 15.6875 9.7748 10.6814 6.92711 14.772 9.22453 3.97543 12.1398 4.62936 numMergedOcc 0
