0 mol 26 unq 0 iso 0 dist 8.69142 4.18634 6.07276 8.8533 5.30297 6.73167 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 8.43523 12.7209 6.07276 6.87744 5.30297 6.73167 numMergedOcc 0
2 mol 39 unq 0 iso 0 dist 8.4436 6.34412 8.20298 10.1263 5.14532 7.99016 numMergedOcc 0
3 mol 39 unq 1 iso 0 dist 8.4436 4.16606 6.13351 10.1263 5.14532 6.41793 numMergedOcc 0
4 mol 112 unq 0 iso 0 dist 8.65004 10.5025 7.67238 5.9819 5.91698 5.43933 numMergedOcc 0
5 mol 112 unq 1 iso 0 dist 9.86487 4.9759 8.72725 5.9819 15.0784 7.44041 numMergedOcc 0
6 mol 131 unq 0 iso 0 dist 9.63085 13.1596 7.75314 11.4427 5.66194 6.78801 numMergedOcc 0
7 mol 154 unq 0 iso 0 dist 5.57798 4.78116 5.2693 12.2203 11.4511 9.82982 numMergedOcc 0
8 mol 225 unq 0 iso 0 dist 7.51337 4.36059 6.94762 11.0013 8.98957 7.8744 numMergedOcc 0
9 mol 225 unq 1 iso 0 dist 8.05594 4.36059 7.7086 11.0013 6.59663 7.8744 numMergedOcc 0
10 mol 236 unq 0 iso 0 dist 5.27184 4.51728 6.15635 9.33359 5.92456 9.14068 numMergedOcc 0
11 mol 239 unq 0 iso 0 dist 9.39578 7.11682 8.95511 13.2311 16.7674 8.88763 numMergedOcc 0
12 mol 239 unq 1 iso 0 dist 9.39578 7.11682 8.95511 13.394 13.3917 6.43209 numMergedOcc 0
13 mol 239 unq 2 iso 0 dist 9.39578 7.11682 8.95511 14.2285 9.38172 8.48769 numMergedOcc 0
14 mol 260 unq 0 iso 0 dist 4.76698 14.0463 9.31888 10.3713 7.16782 9.50634 numMergedOcc 0
15 mol 273 unq 0 iso 0 dist 6.59092 4.3735 5.61969 9.56216 9.76492 5.4307 numMergedOcc 0
16 mol 279 unq 0 iso 0 dist 5.02385 5.4988 9.42255 10.8499 15.1378 7.37478 numMergedOcc 0
