0 mol 10 unq 0 iso 0 dist 7.5169 6.7221 5.37358 8.40467 9.2687 3.96253 numMergedOcc 0
1 mol 18 unq 0 iso 0 dist 6.91876 6.07388 7.88268 8.95648 6.46361 5.67014 numMergedOcc 0
2 mol 29 unq 0 iso 0 dist 8.53135 8.17205 11.6887 8.58191 5.97852 7.075 numMergedOcc 0
3 mol 34 unq 0 iso 0 dist 4.50643 5.46305 6.07258 5.55479 3.92518 3.40337 numMergedOcc 0
4 mol 44 unq 0 iso 0 dist 6.11574 8.27987 8.80588 9.1276 9.9674 8.88563 numMergedOcc 0
5 mol 56 unq 0 iso 0 dist 9.94735 8.30056 4.47154 5.62688 8.68463 9.74518 numMergedOcc 0
6 mol 56 unq 1 iso 0 dist 9.44388 8.30056 7.73483 5.62688 10.5328 9.74518 numMergedOcc 0
7 mol 89 unq 0 iso 0 dist 6.86861 5.50359 4.62728 5.10735 8.04878 4.47717 numMergedOcc 0
8 mol 162 unq 0 iso 0 dist 7.08934 9.7052 8.04855 8.0852 8.69327 3.54419 numMergedOcc 0
9 mol 162 unq 1 iso 0 dist 7.08934 9.7052 8.04855 8.83222 6.65154 5.79041 numMergedOcc 0
10 mol 162 unq 2 iso 0 dist 8.87346 9.7052 7.85299 8.0852 7.61345 3.54419 numMergedOcc 0
11 mol 162 unq 3 iso 0 dist 8.87346 9.7052 7.85299 8.83222 3.21382 5.79041 numMergedOcc 0
12 mol 197 unq 0 iso 0 dist 7.69352 8.76623 6.58404 6.66653 3.35829 3.57029 numMergedOcc 0
13 mol 224 unq 0 iso 0 dist 5.07376 9.71948 9.84417 5.88041 4.67513 13.7032 numMergedOcc 0
14 mol 239 unq 0 iso 0 dist 8.92121 7.9267 6.61453 8.03092 11.1207 5.65659 numMergedOcc 0
15 mol 242 unq 0 iso 0 dist 9.31878 8.60976 4.06455 6.1076 4.46131 4.20404 numMergedOcc 0
16 mol 243 unq 0 iso 0 dist 7.2154 7.63776 8.18969 8.48003 6.87269 13.0132 numMergedOcc 0
17 mol 243 unq 1 iso 0 dist 7.2154 7.63776 8.18969 5.54003 4.4421 8.94322 numMergedOcc 0
