0 mol 61 unq 0 iso 0 dist 6.01552 5.50504 4.90701 5.31827 11.0903 8.76003 numMergedOcc 0
1 mol 70 unq 0 iso 0 dist 9.91797 9.49626 5.6722 16.9284 11.7877 7.92394 numMergedOcc 0
2 mol 70 unq 1 iso 0 dist 9.91797 9.49626 5.6722 17.8674 14.8795 9.93423 numMergedOcc 0
3 mol 70 unq 2 iso 0 dist 9.91797 9.49626 5.6722 8.9375 13.8818 9.34122 numMergedOcc 0
4 mol 95 unq 0 iso 0 dist 9.35364 8.49531 3.96825 6.33328 6.64631 8.67367 numMergedOcc 0
5 mol 126 unq 0 iso 0 dist 8.7347 7.02525 8.85684 7.79653 14.5245 9.5574 numMergedOcc 0
6 mol 134 unq 0 iso 0 dist 8.49649 7.30919 11.0638 9.87127 17.6977 8.94837 numMergedOcc 0
7 mol 209 unq 0 iso 0 dist 6.3344 5.92907 4.1329 10.2593 11.6209 7.95911 numMergedOcc 0
8 mol 235 unq 0 iso 0 dist 6.91126 6.45574 6.84447 5.61388 8.19915 8.21247 numMergedOcc 0
9 mol 235 unq 1 iso 0 dist 9.48967 6.45574 7.38431 5.61388 10.8124 8.21247 numMergedOcc 0
10 mol 235 unq 2 iso 0 dist 6.43002 8.14407 7.38431 6.59128 10.8124 8.21247 numMergedOcc 0
11 mol 236 unq 0 iso 0 dist 6.79115 5.77925 4.38595 11.3746 10.3034 7.17676 numMergedOcc 0
12 mol 236 unq 1 iso 0 dist 6.79115 5.77925 4.38595 5.79263 8.71945 6.68463 numMergedOcc 0
13 mol 248 unq 0 iso 0 dist 8.4908 7.40475 11.014 10.2858 16.4532 6.07192 numMergedOcc 0
14 mol 261 unq 0 iso 0 dist 8.07113 9.80409 4.49913 9.66751 10.4678 7.47164 numMergedOcc 0
15 mol 278 unq 0 iso 0 dist 8.79625 9.91518 13.5373 7.70648 10.7618 6.35287 numMergedOcc 0
16 mol 278 unq 1 iso 0 dist 9.9609 9.91518 11.4765 7.70648 13.9886 6.35287 numMergedOcc 0
