0 mol 17 unq 0 iso 0 dist 8.48453 5.21083 6.53817 7.57677 8.70792 7.83348 numMergedOcc 0
1 mol 68 unq 0 iso 0 dist 6.6606 9.1401 7.14865 7.39492 8.06267 6.31365 numMergedOcc 0
2 mol 68 unq 1 iso 0 dist 6.6606 9.1401 7.14865 4.89623 5.88334 5.08329 numMergedOcc 0
3 mol 78 unq 0 iso 0 dist 7.80757 8.73 9.99029 13.7086 7.91148 17.7256 numMergedOcc 0
4 mol 78 unq 1 iso 0 dist 7.80757 8.73 9.99029 10.9209 6.59794 15.9158 numMergedOcc 0
5 mol 78 unq 2 iso 0 dist 7.80757 8.73 9.99029 15.7494 8.34957 17.574 numMergedOcc 0
6 mol 78 unq 3 iso 0 dist 9.2835 11.9616 9.99029 12.7015 7.91148 17.7256 numMergedOcc 0
7 mol 78 unq 4 iso 0 dist 9.2835 11.9616 9.99029 12.9102 6.59794 15.9158 numMergedOcc 0
8 mol 78 unq 5 iso 0 dist 9.2835 11.9616 9.99029 10.2933 8.34957 17.574 numMergedOcc 0
9 mol 78 unq 6 iso 0 dist 5.02591 8.07212 9.99029 11.1086 7.91148 17.7256 numMergedOcc 0
10 mol 78 unq 7 iso 0 dist 5.02591 8.07212 9.99029 10.2834 6.59794 15.9158 numMergedOcc 0
11 mol 78 unq 8 iso 0 dist 5.02591 8.07212 9.99029 10.0935 8.34957 17.574 numMergedOcc 0
12 mol 132 unq 0 iso 0 dist 9.0339 14.2364 6.2403 10.3456 5.77186 7.87387 numMergedOcc 0
13 mol 132 unq 1 iso 0 dist 9.0339 8.84157 6.495 10.3456 5.77186 6.53135 numMergedOcc 0
14 mol 143 unq 0 iso 0 dist 8.72463 12.8171 7.5984 10.7652 8.99891 5.08025 numMergedOcc 0
15 mol 167 unq 0 iso 0 dist 4.93984 4.72853 8.58946 7.95112 9.86868 11.6251 numMergedOcc 0
16 mol 167 unq 1 iso 0 dist 4.93984 4.72853 8.58946 4.03388 6.83528 6.39898 numMergedOcc 0
17 mol 204 unq 0 iso 0 dist 6.32652 3.96829 6.27396 5.43925 7.16758 7.73767 numMergedOcc 0
18 mol 206 unq 0 iso 0 dist 8.59262 5.2696 7.10166 11.326 6.23183 8.44261 numMergedOcc 0
19 mol 206 unq 1 iso 0 dist 8.59262 15.5823 9.66896 11.326 6.23183 13.8891 numMergedOcc 0
20 mol 218 unq 0 iso 0 dist 5.52981 6.43128 9.88212 8.95992 6.1896 10.5477 numMergedOcc 0
21 mol 218 unq 1 iso 0 dist 5.52981 6.43128 9.88212 6.50485 6.09255 11.445 numMergedOcc 0
22 mol 231 unq 0 iso 0 dist 8.17766 6.17101 9.98232 8.26166 9.9868 13.2586 numMergedOcc 0
23 mol 231 unq 1 iso 0 dist 8.17766 6.17101 9.98232 9.74804 7.3268 12.8691 numMergedOcc 0
24 mol 231 unq 2 iso 0 dist 9.84965 14.1831 9.98232 6.84363 9.9868 13.2586 numMergedOcc 0
25 mol 231 unq 3 iso 0 dist 9.84965 14.1831 9.98232 8.52323 7.3268 12.8691 numMergedOcc 0
26 mol 266 unq 0 iso 0 dist 9.27588 11.574 7.72749 5.83809 8.97531 6.91113 numMergedOcc 0
