0 mol 10 unq 0 iso 0 dist 7.21183 3.69246 7.30932 8.2448 12.6548 5.8369 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 7.21183 3.69246 7.30932 8.93461 9.80689 8.06428 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 8.62527 3.30063 8.36742 6.67455 5.02457 6.70325 numMergedOcc 0
3 mol 32 unq 0 iso 0 dist 7.6082 3.82644 6.93709 5.07106 7.66677 5.42426 numMergedOcc 0
4 mol 32 unq 1 iso 0 dist 7.6082 3.82644 6.93709 4.92166 10.2379 8.03553 numMergedOcc 0
5 mol 32 unq 2 iso 0 dist 4.09276 3.82644 6.38271 5.07106 5.46097 5.42426 numMergedOcc 0
6 mol 32 unq 3 iso 0 dist 4.09276 3.82644 6.38271 4.92166 5.27549 8.03553 numMergedOcc 0
7 mol 32 unq 4 iso 0 dist 9.24687 7.47409 6.93709 10.3801 7.66677 5.42426 numMergedOcc 0
8 mol 32 unq 5 iso 0 dist 9.24687 7.47409 6.93709 14.7692 10.2379 8.03553 numMergedOcc 0
9 mol 34 unq 0 iso 0 dist 5.68877 12.1168 7.07773 14.7192 9.33491 5.68794 numMergedOcc 0
10 mol 34 unq 1 iso 0 dist 5.68877 12.1168 7.07773 18.3682 13.4367 8.9964 numMergedOcc 0
11 mol 45 unq 0 iso 0 dist 8.66843 4.46825 8.55903 10.0837 5.87829 8.42742 numMergedOcc 0
12 mol 78 unq 0 iso 0 dist 6.04611 5.83035 4.45433 10.8417 5.42987 7.50229 numMergedOcc 0
13 mol 154 unq 0 iso 0 dist 8.40395 5.37013 6.1247 13.6505 9.3097 8.76245 numMergedOcc 0
14 mol 154 unq 1 iso 0 dist 8.5081 11.9194 6.1247 8.65008 9.3097 8.76245 numMergedOcc 0
15 mol 181 unq 0 iso 0 dist 9.14877 8.75517 8.07518 13.2206 6.66501 8.76671 numMergedOcc 0
16 mol 220 unq 0 iso 0 dist 6.64341 6.43635 8.67956 8.12934 6.13765 8.06847 numMergedOcc 0
17 mol 220 unq 1 iso 0 dist 7.31315 9.04953 8.67956 10.9575 6.13765 8.06847 numMergedOcc 0
18 mol 265 unq 0 iso 0 dist 8.70514 8.80592 7.7096 8.5774 4.85294 6.04835 numMergedOcc 0
19 mol 265 unq 1 iso 0 dist 8.6462 11.7178 7.7096 8.01664 4.85294 6.04835 numMergedOcc 0
