0 mol 6 unq 0 iso 0 dist 8.30543 6.38732 7.54484 10.8577 6.95628 5.46004 numMergedOcc 0
1 mol 6 unq 1 iso 0 dist 9.94843 12.5999 7.54484 14.7663 6.95628 5.46004 numMergedOcc 0
2 mol 29 unq 0 iso 0 dist 6.73481 3.97609 6.04161 12.0262 7.34641 9.64034 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 5.44077 4.89928 6.34215 10.3479 8.04035 9.04117 numMergedOcc 0
4 mol 130 unq 0 iso 0 dist 9.92685 12.989 9.67398 16.9386 11.2799 7.15213 numMergedOcc 0
5 mol 139 unq 0 iso 0 dist 5.77343 4.37138 7.20542 10.5546 9.781 6.79625 numMergedOcc 0
6 mol 152 unq 0 iso 0 dist 5.28423 5.27395 6.75471 10.064 8.13293 9.21757 numMergedOcc 0
7 mol 168 unq 0 iso 0 dist 9.60268 5.4035 7.337 13.3612 6.11195 9.08906 numMergedOcc 0
8 mol 168 unq 1 iso 0 dist 8.79954 6.46155 7.337 11.9617 6.11195 9.08906 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 5.31333 9.03587 5.27578 10.5988 5.95728 8.25953 numMergedOcc 0
10 mol 192 unq 0 iso 0 dist 8.86627 9.82173 5.77035 13.6997 6.07205 5.08603 numMergedOcc 0
11 mol 192 unq 1 iso 0 dist 9.10569 9.52963 5.77035 13.262 6.07205 5.08603 numMergedOcc 0
12 mol 215 unq 0 iso 0 dist 5.92204 3.522 8.28951 7.16839 6.09605 9.66981 numMergedOcc 0
13 mol 215 unq 1 iso 0 dist 7.16839 3.522 9.66981 5.92204 6.09605 8.28951 numMergedOcc 0
14 mol 266 unq 0 iso 0 dist 9.33791 3.79641 8.62843 10.8595 6.70676 8.95841 numMergedOcc 0
15 mol 272 unq 0 iso 0 dist 7.38085 3.7218 5.38409 11.6897 11.3373 8.45524 numMergedOcc 0
16 mol 283 unq 0 iso 0 dist 8.89292 3.72864 7.18295 8.43009 7.89565 9.19367 numMergedOcc 0
17 mol 283 unq 1 iso 0 dist 8.43009 3.72864 9.19367 8.89292 7.89565 7.18295 numMergedOcc 0
18 mol 287 unq 0 iso 0 dist 7.47179 9.23896 6.06665 13.9075 6.44062 9.38541 numMergedOcc 0
19 mol 288 unq 0 iso 0 dist 7.47179 9.23896 6.06665 13.9075 6.44062 9.38541 numMergedOcc 0
20 mol 289 unq 0 iso 0 dist 7.47179 9.23896 6.06665 13.9075 6.44062 9.38541 numMergedOcc 0
