0 mol 25 unq 0 iso 0 dist 9.23015 10.7149 7.05196 8.97282 8.07318 4.69295 13.2682 6.47509 5.04899 6.55597 numMergedOcc 0
1 mol 25 unq 1 iso 0 dist 9.23015 10.7149 7.05196 4.54526 7.44277 11.6045 13.2682 6.47509 5.04899 12.3944 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 8.74209 5.5249 6.6263 14.5833 8.34145 10.8828 8.06275 5.41726 8.80331 10.0168 numMergedOcc 0
3 mol 43 unq 1 iso 0 dist 8.74209 10.4413 6.75943 14.5833 8.34145 5.07458 12.0618 4.96926 5.73819 6.66407 numMergedOcc 0
4 mol 43 unq 2 iso 0 dist 8.74209 10.4413 6.75943 14.5833 8.34145 5.07458 8.06275 5.41726 6.20293 10.0168 numMergedOcc 0
5 mol 43 unq 3 iso 0 dist 8.74209 10.4413 6.75943 14.5833 8.34145 5.07458 14.4184 10.0383 8.93915 10.9975 numMergedOcc 0
6 mol 43 unq 4 iso 0 dist 9.85555 5.46715 6.6263 14.1685 8.34145 10.8828 13.5835 5.41726 8.80331 10.0168 numMergedOcc 0
7 mol 43 unq 5 iso 0 dist 9.85555 12.902 6.75943 14.1685 8.34145 5.07458 14.4841 4.96926 5.73819 6.66407 numMergedOcc 0
8 mol 43 unq 6 iso 0 dist 9.85555 12.902 6.75943 14.1685 8.34145 5.07458 13.5835 5.41726 6.20293 10.0168 numMergedOcc 0
9 mol 43 unq 7 iso 0 dist 9.85555 12.902 6.75943 14.1685 8.34145 5.07458 19.4359 10.0383 8.93915 10.9975 numMergedOcc 0
10 mol 56 unq 0 iso 0 dist 8.15039 7.70367 9.03564 10.9165 8.77529 9.96534 11.5793 6.75591 8.66265 13.2483 numMergedOcc 0
11 mol 109 unq 0 iso 0 dist 6.62354 5.68669 8.52024 7.53887 9.09348 4.69373 9.26438 5.00433 8.69985 7.07971 numMergedOcc 0
12 mol 109 unq 1 iso 0 dist 8.00085 6.80429 8.52024 7.83378 9.09348 4.69373 6.43255 5.00433 8.69985 7.07971 numMergedOcc 0
13 mol 115 unq 0 iso 0 dist 8.54304 5.98221 6.24825 9.02908 7.65564 6.63111 13.352 6.95773 9.33865 6.39384 numMergedOcc 0
14 mol 115 unq 1 iso 0 dist 8.54304 5.98221 6.24825 9.02908 7.65564 6.63111 11.172 6.01673 5.83991 9.42082 numMergedOcc 0
15 mol 134 unq 0 iso 0 dist 6.14652 7.07625 9.33094 11.6261 8.62504 8.06642 9.79337 7.41373 8.94367 7.21868 numMergedOcc 0
16 mol 134 unq 1 iso 0 dist 6.14652 7.07625 9.33094 11.6261 8.62504 8.06642 10.5814 10.8635 6.37586 7.93372 numMergedOcc 0
17 mol 134 unq 2 iso 0 dist 6.14652 7.07625 9.33094 11.6261 8.62504 8.06642 9.42271 12.3479 6.49416 11.988 numMergedOcc 0
18 mol 134 unq 3 iso 0 dist 6.14652 10.4858 8.69531 11.6261 8.62504 4.00092 9.79337 7.41373 9.86662 7.21868 numMergedOcc 0
19 mol 134 unq 4 iso 0 dist 6.14652 10.4858 8.69531 11.6261 8.62504 4.00092 10.5814 10.8635 9.71307 7.93372 numMergedOcc 0
20 mol 143 unq 0 iso 0 dist 9.11314 10.5234 5.37047 15.2752 9.29944 7.39837 12.9413 4.78563 5.99315 5.40637 numMergedOcc 0
21 mol 186 unq 0 iso 0 dist 9.00537 9.40374 6.61112 12.9635 8.5672 10.8286 10.8152 11.0961 7.54065 17.8564 numMergedOcc 0
22 mol 186 unq 1 iso 0 dist 8.9388 12.4751 6.61112 4.68208 8.5672 10.8286 18.4039 11.0961 7.54065 17.8564 numMergedOcc 0
23 mol 222 unq 0 iso 0 dist 8.63804 4.81906 5.56538 6.42324 8.14294 8.34852 11.4413 6.84862 7.21333 12.0171 numMergedOcc 0
24 mol 222 unq 1 iso 0 dist 8.61619 4.81906 7.48954 6.42324 5.72 8.34852 11.4413 9.53117 7.21333 12.0171 numMergedOcc 0
25 mol 243 unq 0 iso 0 dist 8.96099 5.13362 7.10671 5.76716 8.20943 5.71505 11.9467 5.74165 8.23192 8.69318 numMergedOcc 0
26 mol 243 unq 1 iso 0 dist 6.56525 5.8297 7.10671 9.67191 8.20943 5.71505 10.8689 5.74165 8.23192 8.69318 numMergedOcc 0
27 mol 277 unq 0 iso 0 dist 7.88009 9.57081 8.9682 5.62605 7.16209 3.97543 16.2514 17.6038 9.7748 12.1398 numMergedOcc 0
28 mol 277 unq 1 iso 0 dist 5.80061 9.57081 6.92711 5.62605 4.62936 3.97543 16.2514 14.772 9.7748 12.1398 numMergedOcc 0
