0 mol 56 unq 0 iso 0 dist 8.54845 10.2322 9.77018 13.8224 12.2324 7.89184 numMergedOcc 0
1 mol 56 unq 1 iso 0 dist 8.54845 10.2322 9.77018 10.6971 6.15355 5.91948 numMergedOcc 0
2 mol 100 unq 0 iso 0 dist 9.57498 9.16553 8.96916 11.3211 6.30222 5.30117 numMergedOcc 0
3 mol 109 unq 0 iso 0 dist 8.39771 16.9308 9.45397 11.6771 4.94189 7.22752 numMergedOcc 0
4 mol 133 unq 0 iso 0 dist 7.15203 8.86818 9.79004 9.7105 6.9945 4.79003 numMergedOcc 0
5 mol 144 unq 0 iso 0 dist 8.11591 7.33969 9.81485 9.08956 8.65006 6.03283 numMergedOcc 0
6 mol 144 unq 1 iso 0 dist 8.11591 7.33969 9.81485 11.7978 8.70426 9.05357 numMergedOcc 0
7 mol 217 unq 0 iso 0 dist 5.10683 7.11105 6.74267 9.95617 5.60586 6.72624 numMergedOcc 0
8 mol 217 unq 1 iso 0 dist 5.10683 7.11105 6.74267 6.58871 4.64118 4.92885 numMergedOcc 0
9 mol 222 unq 0 iso 0 dist 8.69148 8.37449 5.47561 13.422 6.84862 8.51427 numMergedOcc 0
10 mol 232 unq 0 iso 0 dist 7.47238 16.9546 9.95045 12.6118 5.42461 7.53576 numMergedOcc 0
11 mol 274 unq 0 iso 0 dist 9.81087 9.24343 5.82876 9.71389 5.22914 5.64169 numMergedOcc 0
12 mol 276 unq 0 iso 0 dist 8.28881 11.4303 9.64575 14.3049 8.86494 9.53331 numMergedOcc 0
13 mol 280 unq 0 iso 0 dist 8.27417 10.5216 8.80588 11.3818 4.90315 6.16546 numMergedOcc 0
