0 mol 5 unq 0 iso 0 dist 5.63583 6.86774 6.96805 5.28962 7.8351 4.07788 numMergedOcc 0
1 mol 59 unq 0 iso 0 dist 5.8166 6.00486 5.41134 7.2878 9.05547 5.29688 numMergedOcc 0
2 mol 59 unq 1 iso 0 dist 5.8166 11.9828 8.61357 7.2878 9.05547 12.0007 numMergedOcc 0
3 mol 71 unq 0 iso 0 dist 5.75102 13.2306 8.39608 12.5726 8.21553 4.93292 numMergedOcc 0
4 mol 71 unq 1 iso 0 dist 5.75102 13.2306 8.39608 8.943 8.22762 9.16746 numMergedOcc 0
5 mol 71 unq 2 iso 0 dist 5.75102 8.95258 7.28815 12.5726 8.21553 6.53623 numMergedOcc 0
6 mol 71 unq 3 iso 0 dist 5.75102 8.95258 7.28815 8.943 8.22762 5.67157 numMergedOcc 0
7 mol 71 unq 4 iso 0 dist 8.80254 15.0191 8.39608 12.1296 8.21553 4.93292 numMergedOcc 0
8 mol 71 unq 5 iso 0 dist 8.80254 15.0191 8.39608 8.50849 8.22762 9.16746 numMergedOcc 0
9 mol 71 unq 6 iso 0 dist 8.80254 5.91587 7.28815 12.1296 8.21553 6.53623 numMergedOcc 0
10 mol 71 unq 7 iso 0 dist 8.80254 5.91587 7.28815 8.50849 8.22762 5.67157 numMergedOcc 0
11 mol 124 unq 0 iso 0 dist 6.31232 6.70976 9.7589 6.27128 7.23052 9.34008 numMergedOcc 0
12 mol 132 unq 0 iso 0 dist 9.10144 8.65247 7.16287 10.3663 6.495 4.90475 numMergedOcc 0
13 mol 132 unq 1 iso 0 dist 9.10144 8.65247 7.16287 9.16496 9.43748 6.34266 numMergedOcc 0
14 mol 133 unq 0 iso 0 dist 4.46578 6.53566 5.9962 6.89903 8.96061 4.58263 numMergedOcc 0
15 mol 133 unq 1 iso 0 dist 4.46578 4.77272 8.61448 6.89903 8.96061 10.1805 numMergedOcc 0
16 mol 167 unq 0 iso 0 dist 6.5782 5.79787 9.65404 5.361 7.83781 6.32863 numMergedOcc 0
17 mol 168 unq 0 iso 0 dist 9.58783 9.46815 9.60268 7.2363 8.8573 6.51864 numMergedOcc 0
18 mol 168 unq 1 iso 0 dist 9.58783 5.35061 8.79954 7.2363 8.8573 5.14137 numMergedOcc 0
19 mol 174 unq 0 iso 0 dist 9.14165 6.80369 4.77805 5.25601 8.4931 5.14186 numMergedOcc 0
20 mol 186 unq 0 iso 0 dist 8.98221 10.7102 5.83898 9.81613 9.08672 9.40372 numMergedOcc 0
21 mol 247 unq 0 iso 0 dist 6.56182 5.45251 8.21164 13.8506 7.29178 14.6138 numMergedOcc 0
22 mol 247 unq 1 iso 0 dist 6.77886 10.0764 8.21164 12.4795 7.29178 14.6138 numMergedOcc 0
23 mol 276 unq 0 iso 0 dist 5.71066 12.7549 9.5388 5.95336 8.95876 10.8564 numMergedOcc 0
24 mol 276 unq 1 iso 0 dist 5.71066 12.7549 9.5388 6.64138 8.259 12.2055 numMergedOcc 0
25 mol 276 unq 2 iso 0 dist 9.69468 10.5398 9.5388 12.4704 8.95876 10.8564 numMergedOcc 0
26 mol 276 unq 3 iso 0 dist 9.69468 10.5398 9.5388 5.77738 8.259 12.2055 numMergedOcc 0
