0 mol 32 unq 0 iso 0 dist 8.89682 6.93709 10.2576 7.66677 12.7419 5.42426 numMergedOcc 0
1 mol 32 unq 1 iso 0 dist 8.89682 6.93709 10.2576 10.2379 17.0521 8.03553 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 6.17472 9.48195 15.1968 6.40908 12.4066 5.68794 numMergedOcc 0
3 mol 34 unq 1 iso 0 dist 6.17472 9.48195 15.1968 9.41024 15.1105 8.9964 numMergedOcc 0
4 mol 78 unq 0 iso 0 dist 9.68277 4.45433 7.30597 5.42987 14.297 7.50229 numMergedOcc 0
5 mol 101 unq 0 iso 0 dist 9.1109 6.54699 5.42817 8.01024 12.3322 7.33426 numMergedOcc 0
6 mol 101 unq 1 iso 0 dist 9.1109 6.54699 5.42817 8.67739 7.42633 8.17175 numMergedOcc 0
7 mol 101 unq 2 iso 0 dist 5.51185 6.54699 4.19577 8.01024 9.39649 7.33426 numMergedOcc 0
8 mol 101 unq 3 iso 0 dist 5.51185 6.54699 4.19577 8.67739 10.68 8.17175 numMergedOcc 0
9 mol 176 unq 0 iso 0 dist 7.02608 9.95907 8.18142 10.5221 12.5147 9.60931 numMergedOcc 0
10 mol 220 unq 0 iso 0 dist 7.0166 9.32305 6.1414 5.63384 9.37894 9.75231 numMergedOcc 0
11 mol 220 unq 1 iso 0 dist 8.75468 9.32305 4.59403 5.63384 7.99464 9.75231 numMergedOcc 0
12 mol 239 unq 0 iso 0 dist 8.33254 7.14918 14.793 4.56036 12.6932 4.44509 numMergedOcc 0
13 mol 239 unq 1 iso 0 dist 8.33254 9.29322 7.07666 13.9377 11.3211 5.4687 numMergedOcc 0
14 mol 269 unq 0 iso 0 dist 9.91093 7.79735 4.41005 10.8859 13.528 9.20068 numMergedOcc 0
15 mol 270 unq 0 iso 0 dist 7.65449 5.2559 3.53146 6.19147 9.69772 9.47295 numMergedOcc 0
16 mol 287 unq 0 iso 0 dist 8.83885 9.57637 7.24849 10.154 12.0343 5.55176 numMergedOcc 0
17 mol 288 unq 0 iso 0 dist 8.83885 9.57637 7.24849 10.154 12.0343 5.55176 numMergedOcc 0
18 mol 289 unq 0 iso 0 dist 8.83885 9.57637 7.24849 10.154 12.0343 5.55176 numMergedOcc 0
