0 mol 62 unq 0 iso 0 dist 9.00943 8.32519 4.85685 7.751 5.6359 9.19512 numMergedOcc 0
1 mol 96 unq 0 iso 0 dist 7.93114 6.93203 4.46676 5.30464 9.4816 10.7891 numMergedOcc 0
2 mol 96 unq 1 iso 0 dist 9.56302 8.68256 4.46676 9.18545 9.4816 10.7891 numMergedOcc 0
3 mol 113 unq 0 iso 0 dist 9.99482 8.78269 5.43595 7.98077 6.53198 8.65807 numMergedOcc 0
4 mol 142 unq 0 iso 0 dist 9.02319 8.40522 10.5548 5.01365 9.64785 5.42679 numMergedOcc 0
5 mol 162 unq 0 iso 0 dist 6.59061 8.7019 5.67773 4.6728 9.19254 8.91326 numMergedOcc 0
6 mol 169 unq 0 iso 0 dist 7.642 6.85177 6.5732 5.68862 5.87263 7.65903 numMergedOcc 0
7 mol 169 unq 1 iso 0 dist 7.642 8.88729 4.14139 5.68862 5.87263 5.97653 numMergedOcc 0
8 mol 204 unq 0 iso 0 dist 8.32373 8.15587 3.31938 10.4563 9.90751 9.36334 numMergedOcc 0
9 mol 206 unq 0 iso 0 dist 5.98212 7.54599 7.16342 13.3593 8.91548 15.2891 numMergedOcc 0
10 mol 225 unq 0 iso 0 dist 7.26267 8.81424 6.04835 5.30128 7.27888 8.74463 numMergedOcc 0
11 mol 225 unq 1 iso 0 dist 7.26267 8.81424 6.04835 7.291 9.0254 13.862 numMergedOcc 0
12 mol 225 unq 2 iso 0 dist 7.26267 9.60949 15.2037 5.30128 7.27888 14.4516 numMergedOcc 0
13 mol 225 unq 3 iso 0 dist 7.26267 9.60949 15.2037 7.291 9.0254 15.1497 numMergedOcc 0
14 mol 260 unq 0 iso 0 dist 7.5129 5.33881 4.38276 15.3558 7.97307 11.8771 numMergedOcc 0
15 mol 260 unq 1 iso 0 dist 7.5129 5.33881 4.38276 9.31424 8.52702 9.73217 numMergedOcc 0
16 mol 287 unq 0 iso 0 dist 9.1299 8.27196 7.52677 4.38471 7.37164 6.22311 numMergedOcc 0
17 mol 288 unq 0 iso 0 dist 9.1299 8.27196 7.52677 4.38471 7.37164 6.22311 numMergedOcc 0
18 mol 289 unq 0 iso 0 dist 9.1299 8.27196 7.52677 4.38471 7.37164 6.22311 numMergedOcc 0
19 mol 292 unq 0 iso 0 dist 6.18484 8.49016 3.88947 6.81187 9.17392 11.6819 numMergedOcc 0
20 mol 292 unq 1 iso 0 dist 6.59906 8.06614 10.8521 13.5359 8.51266 18.9134 numMergedOcc 0
