0 mol 12 unq 0 iso 0 dist 8.99098 7.8865 8.37383 9.79847 15.3098 8.10227 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 8.62527 9.7522 4.52042 9.90986 8.90517 7.11305 numMergedOcc 0
2 mol 30 unq 0 iso 0 dist 7.45133 5.5814 10.3527 8.98564 9.66828 5.53425 numMergedOcc 0
3 mol 30 unq 1 iso 0 dist 7.45133 5.5814 10.3527 7.51725 9.99681 4.20285 numMergedOcc 0
4 mol 63 unq 0 iso 0 dist 9.99115 8.94945 14.2098 8.28839 10.9175 4.27178 numMergedOcc 0
5 mol 63 unq 1 iso 0 dist 9.99115 8.94945 14.2098 7.07396 5.4638 11.6765 numMergedOcc 0
6 mol 98 unq 0 iso 0 dist 8.18252 4.50572 11.8887 6.0995 13.376 7.03983 numMergedOcc 0
7 mol 98 unq 1 iso 0 dist 8.18252 4.50572 11.8887 9.25525 9.76261 13.1657 numMergedOcc 0
8 mol 115 unq 0 iso 0 dist 8.37388 7.95871 5.19652 9.79864 7.88845 9.62029 numMergedOcc 0
9 mol 115 unq 1 iso 0 dist 8.37388 9.80286 11.5824 9.79864 7.88845 4.81028 numMergedOcc 0
10 mol 128 unq 0 iso 0 dist 9.74232 8.01677 6.59161 9.45412 15.6917 10.0888 numMergedOcc 0
11 mol 154 unq 0 iso 0 dist 8.5081 7.26897 10.7202 5.06116 5.32843 5.68978 numMergedOcc 0
12 mol 155 unq 0 iso 0 dist 7.49276 4.44292 4.97552 7.25009 10.541 7.10286 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 8.52322 8.96988 6.94867 9.18289 9.00121 13.0315 numMergedOcc 0
14 mol 186 unq 1 iso 0 dist 8.52322 8.96988 6.94867 6.52441 11.5572 10.6555 numMergedOcc 0
15 mol 186 unq 2 iso 0 dist 8.52322 8.96988 6.94867 6.26168 8.94768 5.75483 numMergedOcc 0
16 mol 225 unq 0 iso 0 dist 7.86364 9.86371 13.4294 9.31012 9.74608 6.46884 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 7.32196 9.32451 6.13639 9.99194 4.12472 5.27215 numMergedOcc 0
18 mol 238 unq 1 iso 0 dist 5.83646 9.94315 10.1036 7.13727 4.48114 7.06793 numMergedOcc 0
19 mol 244 unq 0 iso 0 dist 8.19381 7.65388 8.82711 9.11416 14.199 6.89444 numMergedOcc 0
20 mol 244 unq 1 iso 0 dist 8.93421 7.65388 16.3489 9.11416 15.195 6.89444 numMergedOcc 0
21 mol 244 unq 2 iso 0 dist 7.35657 7.65388 14.6599 9.11416 16.1506 6.89444 numMergedOcc 0
22 mol 244 unq 3 iso 0 dist 6.19605 7.65388 11.9885 9.11416 9.34983 6.89444 numMergedOcc 0
23 mol 264 unq 0 iso 0 dist 6.43775 7.36905 6.46871 9.13546 8.52745 5.71153 numMergedOcc 0
24 mol 264 unq 1 iso 0 dist 6.43775 7.36905 6.46871 8.7365 4.96942 6.87635 numMergedOcc 0
25 mol 264 unq 2 iso 0 dist 6.43775 6.83408 6.62911 9.13546 8.52745 6.56539 numMergedOcc 0
26 mol 264 unq 3 iso 0 dist 6.43775 6.83408 6.62911 8.7365 4.96942 4.76241 numMergedOcc 0
27 mol 292 unq 0 iso 0 dist 9.18581 5.75596 5.52597 9.7061 7.0815 5.50627 numMergedOcc 0
28 mol 292 unq 1 iso 0 dist 9.18581 9.11438 7.37053 9.7061 7.0815 11.5965 numMergedOcc 0
29 mol 292 unq 2 iso 0 dist 9.18581 8.37867 11.698 9.7061 7.0815 14.7162 numMergedOcc 0
