0 mol 12 unq 0 iso 0 dist 4.85969 9.32718 6.28592 4.46781 7.8865 13.4327 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 9.90242 5.97065 5.88467 15.5437 6.89136 11.2591 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 9.07029 5.97065 6.66387 10.1933 6.88695 9.16962 numMergedOcc 0
3 mol 34 unq 0 iso 0 dist 9.12062 5.73257 10.7494 7.16404 7.10899 11.9933 numMergedOcc 0
4 mol 95 unq 0 iso 0 dist 6.82522 6.47401 4.41983 7.94986 8.69069 8.67367 numMergedOcc 0
5 mol 95 unq 1 iso 0 dist 6.82522 6.47401 4.41983 14.1188 9.65047 14.0332 numMergedOcc 0
6 mol 126 unq 0 iso 0 dist 8.7347 6.35364 4.56139 8.50279 8.32241 7.75534 numMergedOcc 0
7 mol 134 unq 0 iso 0 dist 8.49649 5.98435 11.5532 11.9678 9.60369 11.425 numMergedOcc 0
8 mol 134 unq 1 iso 0 dist 8.49649 5.98435 11.5532 13.0109 9.55556 11.2292 numMergedOcc 0
9 mol 134 unq 2 iso 0 dist 8.49649 8.80672 14.5276 11.9678 9.60369 20.301 numMergedOcc 0
10 mol 134 unq 3 iso 0 dist 8.49649 8.80672 14.5276 13.0109 9.55556 21.5049 numMergedOcc 0
11 mol 195 unq 0 iso 0 dist 8.51112 8.64561 5.86183 4.98231 7.63036 9.45278 numMergedOcc 0
12 mol 220 unq 0 iso 0 dist 4.17978 5.13604 3.90017 4.8419 7.16386 7.61951 numMergedOcc 0
13 mol 234 unq 0 iso 0 dist 5.65943 7.54327 4.21173 5.28657 7.46434 6.16063 numMergedOcc 0
14 mol 235 unq 0 iso 0 dist 6.91126 6.43838 5.85485 6.70342 9.11256 10.7117 numMergedOcc 0
15 mol 235 unq 1 iso 0 dist 6.91126 9.24964 14.9183 6.70342 9.11256 9.58736 numMergedOcc 0
16 mol 235 unq 2 iso 0 dist 9.48967 6.43838 15.6099 6.70342 7.08539 10.7117 numMergedOcc 0
17 mol 235 unq 3 iso 0 dist 9.48967 9.24964 4.28284 6.70342 7.08539 9.58736 numMergedOcc 0
18 mol 235 unq 4 iso 0 dist 6.43002 5.71896 4.28284 6.01036 7.08539 9.58736 numMergedOcc 0
