0 mol 10 unq 0 iso 0 dist 9.06457 15.4256 7.93277 21.6382 14.0762 8.88888 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 8.94842 5.41488 7.34325 9.9555 3.55124 6.42037 numMergedOcc 0
2 mol 48 unq 1 iso 0 dist 9.9555 5.41488 6.42037 8.94842 3.55124 7.34325 numMergedOcc 0
3 mol 79 unq 0 iso 0 dist 8.0318 9.57704 7.318 12.7824 8.14284 7.82966 numMergedOcc 0
4 mol 79 unq 1 iso 0 dist 8.0318 9.57704 7.318 16.3634 13.1821 8.26763 numMergedOcc 0
5 mol 79 unq 2 iso 0 dist 8.0318 9.57704 7.318 10.7273 9.61175 6.30814 numMergedOcc 0
6 mol 157 unq 0 iso 0 dist 9.35772 9.8171 6.07906 14.501 5.28985 8.72717 numMergedOcc 0
7 mol 192 unq 0 iso 0 dist 7.578 13.9721 7.49971 14.9863 7.99098 9.07427 numMergedOcc 0
8 mol 192 unq 1 iso 0 dist 9.24926 5.67211 7.49971 13.1737 7.99098 9.07427 numMergedOcc 0
9 mol 195 unq 0 iso 0 dist 5.08438 9.10689 6.65077 14.9716 10.558 9.20541 numMergedOcc 0
10 mol 210 unq 0 iso 0 dist 8.36019 5.14472 9.07676 7.30805 3.59461 6.2401 numMergedOcc 0
11 mol 210 unq 1 iso 0 dist 8.36019 12.3142 9.71107 16.939 10.6482 7.80421 numMergedOcc 0
12 mol 210 unq 2 iso 0 dist 8.36019 12.3142 9.71107 7.30805 3.59461 9.7449 numMergedOcc 0
13 mol 210 unq 3 iso 0 dist 7.30805 5.14472 6.2401 8.36019 3.59461 9.07676 numMergedOcc 0
14 mol 210 unq 4 iso 0 dist 7.30805 12.3142 9.7449 16.939 12.6352 7.80421 numMergedOcc 0
15 mol 210 unq 5 iso 0 dist 7.30805 12.3142 9.7449 8.36019 3.59461 9.71107 numMergedOcc 0
16 mol 217 unq 0 iso 0 dist 8.46235 12.3099 8.99484 13.721 6.12994 7.00456 numMergedOcc 0
17 mol 217 unq 1 iso 0 dist 5.27487 13.5035 8.99484 9.71696 6.12994 7.00456 numMergedOcc 0
18 mol 218 unq 0 iso 0 dist 8.38813 12.9434 9.65132 20.8027 16.3767 9.70462 numMergedOcc 0
19 mol 222 unq 0 iso 0 dist 5.07975 10.4672 7.99441 4.85015 3.58181 6.71817 numMergedOcc 0
20 mol 222 unq 1 iso 0 dist 5.07975 10.4672 7.99441 8.15345 8.23638 8.41524 numMergedOcc 0
21 mol 222 unq 2 iso 0 dist 4.85015 10.4672 6.71817 5.07975 3.58181 7.99441 numMergedOcc 0
22 mol 222 unq 3 iso 0 dist 4.85015 10.4672 6.71817 8.15345 4.79329 8.41524 numMergedOcc 0
23 mol 222 unq 4 iso 0 dist 8.15345 10.4672 8.41524 5.07975 8.23638 7.99441 numMergedOcc 0
24 mol 222 unq 5 iso 0 dist 8.15345 10.4672 8.41524 4.85015 4.79329 6.71817 numMergedOcc 0
25 mol 283 unq 0 iso 0 dist 9.4181 8.51629 5.32876 10.6234 3.46787 7.60296 numMergedOcc 0
26 mol 283 unq 1 iso 0 dist 5.05882 4.67572 5.32876 8.12067 3.46787 7.60296 numMergedOcc 0
