0 mol 12 unq 0 iso 0 dist 7.99569 8.18296 5.25297 6.1378 9.8142 10.7969 numMergedOcc 0
1 mol 17 unq 0 iso 0 dist 6.80314 9.78918 7.31113 7.83348 5.16502 10.1852 numMergedOcc 0
2 mol 17 unq 1 iso 0 dist 6.80314 9.78918 7.31113 4.2802 8.26398 12.7769 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 6.8073 5.60663 9.17835 10.7407 8.12997 14.9886 numMergedOcc 0
4 mol 48 unq 1 iso 0 dist 6.8073 5.60663 9.17835 10.8995 6.13153 14.1426 numMergedOcc 0
5 mol 48 unq 2 iso 0 dist 6.8073 5.60663 9.17835 10.5685 5.7836 10.0533 numMergedOcc 0
6 mol 48 unq 3 iso 0 dist 6.8073 5.60663 9.17835 5.44298 7.32996 7.47783 numMergedOcc 0
7 mol 48 unq 4 iso 0 dist 6.8073 5.60663 9.17835 4.92775 5.89173 9.6736 numMergedOcc 0
8 mol 48 unq 5 iso 0 dist 5.60663 6.8073 9.17835 11.8742 8.56365 15.5445 numMergedOcc 0
9 mol 48 unq 6 iso 0 dist 5.60663 6.8073 9.17835 5.44298 7.47783 7.32996 numMergedOcc 0
10 mol 48 unq 7 iso 0 dist 5.60663 6.8073 9.17835 9.10301 8.74151 13.8202 numMergedOcc 0
11 mol 48 unq 8 iso 0 dist 5.60663 6.8073 9.17835 7.24268 8.69662 11.605 numMergedOcc 0
12 mol 79 unq 0 iso 0 dist 6.64915 7.99438 4.44577 8.65653 5.79139 10.0108 numMergedOcc 0
13 mol 92 unq 0 iso 0 dist 5.74593 8.02376 6.3583 3.63696 8.4219 10.2864 numMergedOcc 0
14 mol 93 unq 0 iso 0 dist 7.13064 7.8962 4.37353 9.6722 5.56839 7.83506 numMergedOcc 0
15 mol 93 unq 1 iso 0 dist 7.8962 7.13064 4.37353 9.6722 7.83506 5.56839 numMergedOcc 0
16 mol 128 unq 0 iso 0 dist 7.61237 6.51968 10.0457 8.12622 7.4442 12.3001 numMergedOcc 0
17 mol 148 unq 0 iso 0 dist 6.86997 7.46919 4.32771 7.34563 9.17462 5.75959 numMergedOcc 0
18 mol 148 unq 1 iso 0 dist 6.86997 7.46919 4.32771 3.54257 8.74878 10.0716 numMergedOcc 0
19 mol 148 unq 2 iso 0 dist 6.86997 8.24581 5.84014 7.34563 9.17462 6.6946 numMergedOcc 0
20 mol 148 unq 3 iso 0 dist 6.86997 8.24581 5.84014 3.54257 8.74878 11.5421 numMergedOcc 0
21 mol 148 unq 4 iso 0 dist 7.46919 6.86997 4.32771 7.34563 5.75959 9.17462 numMergedOcc 0
22 mol 148 unq 5 iso 0 dist 7.46919 8.24581 4.26306 7.34563 5.75959 6.6946 numMergedOcc 0
23 mol 148 unq 6 iso 0 dist 8.24581 6.86997 5.84014 7.34563 6.6946 9.17462 numMergedOcc 0
24 mol 148 unq 7 iso 0 dist 8.24581 7.46919 4.26306 7.34563 6.6946 5.75959 numMergedOcc 0
25 mol 150 unq 0 iso 0 dist 6.79381 7.36989 4.39943 7.33121 9.01668 5.4798 numMergedOcc 0
26 mol 150 unq 1 iso 0 dist 6.79381 7.36989 4.39943 3.59609 8.74018 10.0288 numMergedOcc 0
27 mol 150 unq 2 iso 0 dist 6.79381 8.17805 5.93611 7.33121 9.01668 6.32391 numMergedOcc 0
28 mol 150 unq 3 iso 0 dist 6.79381 8.17805 5.93611 3.59609 8.74018 11.5569 numMergedOcc 0
29 mol 150 unq 4 iso 0 dist 7.36989 6.79381 4.39943 7.33121 5.4798 9.01668 numMergedOcc 0
30 mol 150 unq 5 iso 0 dist 7.36989 8.17805 4.30207 7.33121 5.4798 6.32391 numMergedOcc 0
31 mol 150 unq 6 iso 0 dist 8.17805 6.79381 5.93611 7.33121 6.32391 9.01668 numMergedOcc 0
32 mol 150 unq 7 iso 0 dist 8.17805 7.36989 4.30207 7.33121 6.32391 5.4798 numMergedOcc 0
33 mol 188 unq 0 iso 0 dist 6.20426 6.47305 6.28555 8.6599 8.4784 13.4764 numMergedOcc 0
34 mol 194 unq 0 iso 0 dist 5.4455 8.09776 9.4131 11.7008 8.43182 17.7356 numMergedOcc 0
35 mol 232 unq 0 iso 0 dist 6.83927 9.25162 5.77703 6.92845 9.89191 9.83281 numMergedOcc 0
