0 mol 26 unq 0 iso 0 dist 9.10233 7.90324 11.7206 8.63439 12.9685 5.54542 numMergedOcc 0
1 mol 29 unq 0 iso 0 dist 7.77822 9.39717 5.44062 9.56672 4.78355 3.60586 numMergedOcc 0
2 mol 29 unq 1 iso 0 dist 7.77822 9.39717 5.44062 8.00338 6.65851 5.99096 numMergedOcc 0
3 mol 62 unq 0 iso 0 dist 6.75432 8.95848 6.12554 5.23167 3.70802 5.85606 numMergedOcc 0
4 mol 62 unq 1 iso 0 dist 8.45469 8.95848 7.8331 5.23167 3.66673 5.85606 numMergedOcc 0
5 mol 65 unq 0 iso 0 dist 7.72373 8.70783 4.37601 9.42411 9.15718 13.2346 numMergedOcc 0
6 mol 65 unq 1 iso 0 dist 7.72373 9.20162 10.2204 9.42411 9.15718 12.8148 numMergedOcc 0
7 mol 93 unq 0 iso 0 dist 7.04155 8.6701 6.87756 8.345 7.05304 12.3169 numMergedOcc 0
8 mol 93 unq 1 iso 0 dist 7.04155 8.6701 6.87756 6.06155 3.89959 9.11323 numMergedOcc 0
9 mol 93 unq 2 iso 0 dist 7.04155 6.85457 5.82092 8.345 7.05304 11.9244 numMergedOcc 0
10 mol 93 unq 3 iso 0 dist 7.04155 6.85457 5.82092 6.06155 3.89959 8.52329 numMergedOcc 0
11 mol 98 unq 0 iso 0 dist 8.96016 9.66226 14.1628 5.61418 6.71463 13.4478 numMergedOcc 0
12 mol 103 unq 0 iso 0 dist 6.95777 6.37224 9.02065 7.91691 9.06356 9.33661 numMergedOcc 0
13 mol 113 unq 0 iso 0 dist 9.16474 5.7085 7.09012 6.38269 9.30891 6.29259 numMergedOcc 0
14 mol 113 unq 1 iso 0 dist 9.16474 5.7085 7.09012 7.11196 7.62615 7.08122 numMergedOcc 0
15 mol 120 unq 0 iso 0 dist 8.99783 6.50614 9.77339 6.84006 5.90666 4.26413 numMergedOcc 0
16 mol 120 unq 1 iso 0 dist 8.99783 9.2903 5.13046 6.84006 5.90666 3.64386 numMergedOcc 0
17 mol 120 unq 2 iso 0 dist 8.82602 9.29305 9.77339 8.02114 5.90666 4.26413 numMergedOcc 0
18 mol 260 unq 0 iso 0 dist 7.69551 7.23618 6.49889 7.13397 7.27279 4.07425 numMergedOcc 0
19 mol 260 unq 1 iso 0 dist 7.69551 7.23618 6.49889 5.33278 5.97575 9.36278 numMergedOcc 0
20 mol 278 unq 0 iso 0 dist 4.8627 8.31165 6.60208 8.69111 7.14333 8.79088 numMergedOcc 0
21 mol 278 unq 1 iso 0 dist 5.41035 8.31165 4.19643 8.69111 5.40345 8.79088 numMergedOcc 0
