0 mol 10 unq 0 iso 0 dist 9.1125 9.03002 6.48748 11.8187 9.5819 14.1989 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 8.09675 8.67532 6.97502 10.8929 6.73832 10.8051 numMergedOcc 0
2 mol 73 unq 1 iso 0 dist 8.09675 8.67532 6.97502 13.4503 7.85973 13.7608 numMergedOcc 0
3 mol 74 unq 0 iso 0 dist 9.09394 9.99155 13.9169 6.2954 8.27842 14.0363 numMergedOcc 0
4 mol 86 unq 0 iso 0 dist 8.32885 8.88225 6.51657 4.44978 8.45348 11.7178 numMergedOcc 0
5 mol 86 unq 1 iso 0 dist 8.32885 8.88225 6.51657 8.34552 8.43052 12.6736 numMergedOcc 0
6 mol 86 unq 2 iso 0 dist 9.14653 9.49308 6.51657 7.95883 8.45348 11.7178 numMergedOcc 0
7 mol 86 unq 3 iso 0 dist 9.14653 9.49308 6.51657 6.61451 8.43052 12.6736 numMergedOcc 0
8 mol 88 unq 0 iso 0 dist 5.74637 7.74197 13.1838 9.22301 8.30943 15.9319 numMergedOcc 0
9 mol 88 unq 1 iso 0 dist 5.74637 7.86537 12.6939 9.22301 8.30943 13.6517 numMergedOcc 0
10 mol 88 unq 2 iso 0 dist 5.74637 6.35462 6.63027 9.22301 8.30943 13.957 numMergedOcc 0
11 mol 213 unq 0 iso 0 dist 8.72285 7.88794 7.38 4.7297 8.93676 11.4732 numMergedOcc 0
12 mol 250 unq 0 iso 0 dist 5.43868 9.16048 6.52586 11.1655 9.83369 15.6856 numMergedOcc 0
13 mol 250 unq 1 iso 0 dist 9.80833 9.16048 6.44136 15.3004 9.31494 15.4797 numMergedOcc 0
14 mol 265 unq 0 iso 0 dist 9.81689 7.04833 10.4495 7.40176 9.35563 11.7979 numMergedOcc 0
15 mol 274 unq 0 iso 0 dist 6.28023 9.09967 5.7574 7.64336 8.04439 11.8362 numMergedOcc 0
16 mol 274 unq 1 iso 0 dist 6.28023 8.49076 7.23876 7.64336 8.04439 6.36173 numMergedOcc 0
17 mol 287 unq 0 iso 0 dist 7.47179 7.26542 5.10722 9.43796 8.50964 12.4366 numMergedOcc 0
18 mol 288 unq 0 iso 0 dist 7.47179 7.26542 5.10722 9.43796 8.50964 12.4366 numMergedOcc 0
19 mol 289 unq 0 iso 0 dist 7.47179 7.26542 5.10722 9.43796 8.50964 12.4366 numMergedOcc 0
