0 mol 9 unq 0 iso 0 dist 9.93613 11.7623 9.78006 6.26276 7.28672 9.62394 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 8.70141 13.2653 4.93188 13.5984 9.75636 8.70827 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 8.70141 13.2653 4.93188 18.4559 10.0715 6.73939 numMergedOcc 0
3 mol 24 unq 2 iso 0 dist 8.70141 5.80023 9.24958 13.5984 9.75636 9.12854 numMergedOcc 0
4 mol 25 unq 0 iso 0 dist 5.97432 6.17631 5.81959 7.05148 6.61233 8.6653 numMergedOcc 0
5 mol 25 unq 1 iso 0 dist 5.97432 5.59268 6.90155 11.6272 11.0508 6.16347 numMergedOcc 0
6 mol 25 unq 2 iso 0 dist 5.97432 5.59268 6.90155 7.05148 6.61233 7.92503 numMergedOcc 0
7 mol 26 unq 0 iso 0 dist 6.73259 8.18809 8.6385 9.27369 5.30297 7.36856 numMergedOcc 0
8 mol 26 unq 1 iso 0 dist 8.60352 7.06347 8.6385 10.6535 5.30297 7.36856 numMergedOcc 0
9 mol 44 unq 0 iso 0 dist 7.03812 11.0744 7.52117 10.95 5.1728 9.6782 numMergedOcc 0
10 mol 119 unq 0 iso 0 dist 6.13391 6.0968 6.98934 12.3696 8.28905 8.99399 numMergedOcc 0
11 mol 148 unq 0 iso 0 dist 5.06687 9.27313 9.74542 11.0479 7.23332 9.91993 numMergedOcc 0
12 mol 148 unq 1 iso 0 dist 5.06687 9.27313 9.74542 9.80819 7.89336 6.22055 numMergedOcc 0
13 mol 150 unq 0 iso 0 dist 5.09809 9.25213 9.6606 11.1963 7.35366 9.96691 numMergedOcc 0
14 mol 150 unq 1 iso 0 dist 5.09809 9.25213 9.6606 9.81665 7.86976 6.14675 numMergedOcc 0
15 mol 150 unq 2 iso 0 dist 5.09809 9.25213 9.6606 13.8927 11.8012 9.24244 numMergedOcc 0
16 mol 159 unq 0 iso 0 dist 9.90625 10.6428 7.25742 18.0894 10.3427 9.17787 numMergedOcc 0
17 mol 159 unq 1 iso 0 dist 9.90625 10.6428 7.25742 12.8147 7.97232 8.4858 numMergedOcc 0
18 mol 163 unq 0 iso 0 dist 5.80513 4.12904 8.38738 9.62943 8.55624 9.07943 numMergedOcc 0
19 mol 175 unq 0 iso 0 dist 8.4673 4.27736 5.4969 13.6335 8.94702 9.39352 numMergedOcc 0
20 mol 175 unq 1 iso 0 dist 9.12296 4.27736 7.35824 13.6335 10.3786 9.39352 numMergedOcc 0
21 mol 194 unq 0 iso 0 dist 7.47107 10.2633 6.26839 13.3459 5.92931 8.65535 numMergedOcc 0
22 mol 194 unq 1 iso 0 dist 7.47107 7.72655 8.83356 10.0521 12.361 8.29382 numMergedOcc 0
23 mol 194 unq 2 iso 0 dist 7.47107 7.72655 8.83356 9.76361 7.50057 6.72379 numMergedOcc 0
24 mol 210 unq 0 iso 0 dist 7.31388 3.84723 5.37446 10.7279 7.1777 7.10826 numMergedOcc 0
25 mol 235 unq 0 iso 0 dist 9.77502 13.1002 6.39158 9.52022 7.85398 6.36341 numMergedOcc 0
26 mol 240 unq 0 iso 0 dist 8.44671 15.9853 9.47583 22.5716 15.5587 6.68687 numMergedOcc 0
27 mol 258 unq 0 iso 0 dist 8.78354 11.5659 6.70815 16.2957 8.10604 7.21311 numMergedOcc 0
28 mol 274 unq 0 iso 0 dist 7.65671 5.9882 9.56685 9.02071 5.36428 9.85289 numMergedOcc 0
29 mol 274 unq 1 iso 0 dist 7.3996 5.9882 8.49922 9.02071 11.9754 9.85289 numMergedOcc 0
30 mol 279 unq 0 iso 0 dist 5.63154 8.33297 6.43341 11.3989 5.89415 9.09855 numMergedOcc 0
