0 mol 6 unq 0 iso 0 dist 9.1538 14.204 7.54484 14.8916 7.50895 8.31647 numMergedOcc 0
1 mol 6 unq 1 iso 0 dist 7.46244 6.67429 7.54484 7.6948 7.50895 8.31647 numMergedOcc 0
2 mol 21 unq 0 iso 0 dist 9.83589 5.38502 7.63222 9.76497 7.04837 8.6232 numMergedOcc 0
3 mol 21 unq 1 iso 0 dist 6.29808 10.7179 7.30688 12.0799 10.1117 8.07914 numMergedOcc 0
4 mol 32 unq 0 iso 0 dist 7.48994 8.7845 7.29783 9.38777 3.95884 9.28158 numMergedOcc 0
5 mol 66 unq 0 iso 0 dist 6.32532 4.35884 7.3084 7.16147 3.7783 8.68658 numMergedOcc 0
6 mol 67 unq 0 iso 0 dist 6.89527 10.3712 6.44825 14.2197 11.2455 8.27009 numMergedOcc 0
7 mol 67 unq 1 iso 0 dist 6.89527 10.3712 6.44825 10.0617 3.83735 5.80736 numMergedOcc 0
8 mol 76 unq 0 iso 0 dist 8.25047 7.13692 6.14248 9.76901 6.1999 5.73235 numMergedOcc 0
9 mol 76 unq 1 iso 0 dist 8.25047 8.29882 6.97936 9.76901 6.1999 7.48127 numMergedOcc 0
10 mol 98 unq 0 iso 0 dist 7.63284 9.79578 6.84952 11.0402 6.40382 6.30896 numMergedOcc 0
11 mol 129 unq 0 iso 0 dist 8.4375 9.72618 9.31543 13.2264 9.82512 7.6453 numMergedOcc 0
12 mol 129 unq 1 iso 0 dist 8.62413 9.72618 8.85652 13.2264 6.31483 7.6453 numMergedOcc 0
13 mol 134 unq 0 iso 0 dist 9.13631 8.85304 5.20195 9.31167 7.45747 9.88178 numMergedOcc 0
14 mol 187 unq 0 iso 0 dist 8.00104 6.06679 5.7938 9.383 8.06583 5.58167 numMergedOcc 0
15 mol 187 unq 1 iso 0 dist 8.00104 6.06679 5.7938 9.5198 3.94358 8.0501 numMergedOcc 0
16 mol 220 unq 0 iso 0 dist 8.15661 5.0997 6.16832 10.6506 3.95204 6.80214 numMergedOcc 0
17 mol 225 unq 0 iso 0 dist 7.9002 12.9829 8.94981 17.3327 11.8703 7.65121 numMergedOcc 0
18 mol 273 unq 0 iso 0 dist 7.05843 6.97379 6.95569 11.2142 12.7125 5.78262 numMergedOcc 0
19 mol 273 unq 1 iso 0 dist 7.05843 6.97379 6.95569 14.1243 10.8576 7.6489 numMergedOcc 0
20 mol 292 unq 0 iso 0 dist 9.18386 5.44638 9.24101 6.51561 5.90311 5.83342 numMergedOcc 0
