0 mol 44 unq 0 iso 0 dist 9.03899 9.26518 4.94258 4.83564 6.11574 5.89913 numMergedOcc 0
1 mol 44 unq 1 iso 0 dist 9.03899 9.26518 4.94258 4.29306 10.2193 9.80946 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 8.70465 9.73501 12.0515 10.116 10.8175 5.7576 numMergedOcc 0
3 mol 116 unq 0 iso 0 dist 8.71613 8.83566 8.89777 4.39917 11.252 7.70636 numMergedOcc 0
4 mol 116 unq 1 iso 0 dist 8.71613 8.83566 8.89777 7.43565 10.2448 6.82267 numMergedOcc 0
5 mol 124 unq 0 iso 0 dist 6.31955 6.67979 5.3096 5.87352 8.03603 9.66083 numMergedOcc 0
6 mol 172 unq 0 iso 0 dist 8.87108 9.66616 7.9274 8.65462 12.2672 7.3485 numMergedOcc 0
7 mol 172 unq 1 iso 0 dist 6.16303 9.66616 7.16279 8.65462 4.90175 7.3485 numMergedOcc 0
8 mol 172 unq 2 iso 0 dist 9.4868 9.66616 10.3517 8.65462 10.8142 7.3485 numMergedOcc 0
9 mol 182 unq 0 iso 0 dist 9.66051 4.88723 6.68224 5.68283 12.7209 9.91132 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 5.82681 8.86574 5.28021 4.95637 7.6409 7.62945 numMergedOcc 0
11 mol 193 unq 0 iso 0 dist 7.77216 8.29723 15.3742 13.8145 20.7897 6.10013 numMergedOcc 0
12 mol 226 unq 0 iso 0 dist 9.45587 7.4717 13.0829 8.32779 17.2617 8.06328 numMergedOcc 0
13 mol 241 unq 0 iso 0 dist 9.89398 7.65636 8.58146 4.51587 8.00841 9.87415 numMergedOcc 0
14 mol 260 unq 0 iso 0 dist 8.88803 8.90109 13.0341 7.3067 13.9457 4.20369 numMergedOcc 0
