0 mol 37 unq 0 iso 0 dist 7.47638 11.746 5.98359 3.96491 8.5893 12.0017 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 4.22514 9.45804 6.10175 11.8083 9.63616 7.25076 numMergedOcc 0
2 mol 78 unq 0 iso 0 dist 8.06502 13.4735 9.68277 9.26191 6.50622 4.90647 numMergedOcc 0
3 mol 78 unq 1 iso 0 dist 8.06502 13.4735 9.68277 6.42604 4.45433 7.30597 numMergedOcc 0
4 mol 98 unq 0 iso 0 dist 8.87984 15.5171 8.87856 9.40876 8.73798 11.2684 numMergedOcc 0
5 mol 98 unq 1 iso 0 dist 8.87984 6.06642 6.2491 9.40876 8.73798 4.05759 numMergedOcc 0
6 mol 98 unq 2 iso 0 dist 9.0584 6.06642 3.59451 9.40876 5.24616 4.05759 numMergedOcc 0
7 mol 130 unq 0 iso 0 dist 7.71664 4.59384 7.86001 5.17954 9.04366 4.81304 numMergedOcc 0
8 mol 176 unq 0 iso 0 dist 8.36606 6.43713 7.02608 3.84631 9.95907 8.18142 numMergedOcc 0
9 mol 184 unq 0 iso 0 dist 8.45309 7.53305 5.13722 10.5062 9.511 9.62165 numMergedOcc 0
10 mol 184 unq 1 iso 0 dist 8.45309 7.53305 5.13722 8.57356 7.72354 9.27535 numMergedOcc 0
11 mol 209 unq 0 iso 0 dist 8.31839 5.54639 8.40779 6.51877 8.38539 5.09635 numMergedOcc 0
12 mol 212 unq 0 iso 0 dist 9.88141 7.4422 6.41916 5.68716 9.20546 4.29261 numMergedOcc 0
13 mol 239 unq 0 iso 0 dist 9.26044 10.7857 8.33254 11.2097 7.14918 14.793 numMergedOcc 0
14 mol 239 unq 1 iso 0 dist 9.26044 10.7857 8.33254 6.10489 9.29322 7.07666 numMergedOcc 0
15 mol 249 unq 0 iso 0 dist 6.23348 4.77887 6.04688 4.76162 5.7671 7.19269 numMergedOcc 0
16 mol 261 unq 0 iso 0 dist 7.22085 8.52263 9.64886 4.0358 9.90119 12.0622 numMergedOcc 0
17 mol 265 unq 0 iso 0 dist 8.9413 6.97261 5.10595 3.8221 8.57848 4.75288 numMergedOcc 0
18 mol 279 unq 0 iso 0 dist 5.90003 11.9206 7.88102 3.83238 5.16266 8.61444 numMergedOcc 0
19 mol 279 unq 1 iso 0 dist 5.90003 9.54906 7.93694 3.83238 5.16266 6.1215 numMergedOcc 0
20 mol 283 unq 0 iso 0 dist 7.11407 10.6738 6.15136 9.8348 9.33601 11.413 numMergedOcc 0
