0 mol 18 unq 0 iso 0 dist 6.01053 5.32758 5.10885 11.1731 5.67014 7.60512 numMergedOcc 0
1 mol 27 unq 0 iso 0 dist 8.8018 6.35516 5.76475 10.757 3.39295 5.9635 numMergedOcc 0
2 mol 29 unq 0 iso 0 dist 8.94936 10.2077 9.02912 11.1362 6.0516 9.41017 numMergedOcc 0
3 mol 100 unq 0 iso 0 dist 6.92671 6.12107 6.97739 9.90751 3.50258 7.81446 numMergedOcc 0
4 mol 100 unq 1 iso 0 dist 6.92671 6.12107 6.97739 9.21662 6.13237 6.55173 numMergedOcc 0
5 mol 100 unq 2 iso 0 dist 6.92671 5.42531 8.4705 9.21662 6.13237 6.59691 numMergedOcc 0
6 mol 186 unq 0 iso 0 dist 9.83935 11.7429 7.81069 17.8564 9.62603 9.99396 numMergedOcc 0
7 mol 186 unq 1 iso 0 dist 9.16817 8.98536 7.51714 13.141 5.33111 8.92115 numMergedOcc 0
8 mol 192 unq 0 iso 0 dist 8.91445 6.70517 5.47004 14.6825 8.28507 9.40971 numMergedOcc 0
9 mol 192 unq 1 iso 0 dist 8.91445 5.69727 7.36742 14.6825 8.28507 9.8428 numMergedOcc 0
10 mol 210 unq 0 iso 0 dist 5.62219 7.67559 6.6588 8.63693 3.61565 9.68477 numMergedOcc 0
11 mol 231 unq 0 iso 0 dist 7.31553 9.0443 8.68815 9.97669 5.49654 9.60504 numMergedOcc 0
12 mol 252 unq 0 iso 0 dist 7.48298 6.35641 7.89384 7.15764 9.49612 8.09509 numMergedOcc 0
13 mol 258 unq 0 iso 0 dist 7.98028 4.66802 5.96512 10.8595 3.34873 7.95464 numMergedOcc 0
14 mol 258 unq 1 iso 0 dist 5.8473 6.93678 5.96512 9.17612 3.34873 7.95464 numMergedOcc 0
15 mol 274 unq 0 iso 0 dist 8.98154 5.29529 9.71673 12.8334 16.599 8.60027 numMergedOcc 0
16 mol 277 unq 0 iso 0 dist 6.64082 7.70529 9.04531 8.9682 14.6245 9.26157 numMergedOcc 0
