0 mol 14 unq 0 iso 0 dist 9.42142 8.13983 7.00835 5.2767 7.54797 8.73627 numMergedOcc 0
1 mol 59 unq 0 iso 0 dist 8.69443 9.59244 8.14829 5.43469 7.37357 10.9609 numMergedOcc 0
2 mol 63 unq 0 iso 0 dist 7.89201 9.87719 4.49178 4.55823 7.07849 10.7992 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 9.06225 7.47794 5.31439 17.6911 9.45905 14.0817 numMergedOcc 0
4 mol 83 unq 0 iso 0 dist 9.35188 9.21173 7.18373 10.944 8.81183 10.3616 numMergedOcc 0
5 mol 109 unq 0 iso 0 dist 7.66832 8.73648 5.5332 14.084 9.0224 13.1633 numMergedOcc 0
6 mol 110 unq 0 iso 0 dist 5.43052 8.181 9.01856 6.72551 7.24538 12.2973 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 9.44788 8.82535 7.64443 4.46648 9.40633 10.7559 numMergedOcc 0
8 mol 119 unq 1 iso 0 dist 9.44788 8.82535 7.64443 9.33725 9.42432 14.7666 numMergedOcc 0
9 mol 119 unq 2 iso 0 dist 9.44788 8.82535 7.64443 10.872 9.22776 14.5777 numMergedOcc 0
10 mol 119 unq 3 iso 0 dist 9.44788 6.18763 6.83988 4.46648 9.40633 6.49205 numMergedOcc 0
11 mol 119 unq 4 iso 0 dist 9.44788 6.18763 6.83988 9.33725 9.42432 11.3751 numMergedOcc 0
12 mol 119 unq 5 iso 0 dist 9.44788 6.18763 6.83988 10.872 9.22776 13.3876 numMergedOcc 0
13 mol 119 unq 6 iso 0 dist 9.44788 8.44385 14.8957 4.46648 9.40633 12.6552 numMergedOcc 0
14 mol 119 unq 7 iso 0 dist 9.44788 8.44385 14.8957 9.33725 9.42432 17.4574 numMergedOcc 0
15 mol 119 unq 8 iso 0 dist 9.44788 8.44385 14.8957 10.872 9.22776 16.4385 numMergedOcc 0
16 mol 119 unq 9 iso 0 dist 9.44788 5.63005 12.1168 4.46648 9.40633 10.0583 numMergedOcc 0
17 mol 119 unq 10 iso 0 dist 9.44788 5.63005 12.1168 9.33725 9.42432 13.3963 numMergedOcc 0
18 mol 119 unq 11 iso 0 dist 9.44788 5.63005 12.1168 10.872 9.22776 11.7808 numMergedOcc 0
19 mol 133 unq 0 iso 0 dist 6.85651 9.3894 8.00493 11.5618 8.60913 15.397 numMergedOcc 0
20 mol 133 unq 1 iso 0 dist 6.23615 9.50322 14.5344 4.70999 8.43088 12.7635 numMergedOcc 0
21 mol 133 unq 2 iso 0 dist 6.23615 5.82404 7.96098 4.70999 8.43088 10.4418 numMergedOcc 0
22 mol 133 unq 3 iso 0 dist 8.63817 5.86531 6.73114 12.4479 8.43088 11.5405 numMergedOcc 0
23 mol 186 unq 0 iso 0 dist 9.71223 8.96988 9.653 9.45075 8.43722 14.3315 numMergedOcc 0
24 mol 212 unq 0 iso 0 dist 7.73701 8.062 9.7586 7.59302 9.12948 13.1777 numMergedOcc 0
25 mol 218 unq 0 iso 0 dist 6.2441 7.0843 9.92743 6.63238 8.73468 13.0632 numMergedOcc 0
26 mol 218 unq 1 iso 0 dist 6.2441 7.73315 12.0573 6.63238 8.73468 11.9872 numMergedOcc 0
27 mol 218 unq 2 iso 0 dist 6.2441 6.9398 8.31343 6.63238 8.73468 9.92412 numMergedOcc 0
28 mol 234 unq 0 iso 0 dist 6.56262 7.50424 4.93539 5.31797 6.41452 5.00515 numMergedOcc 0
29 mol 236 unq 0 iso 0 dist 8.01164 9.89665 13.4013 6.83211 7.34709 16.2964 numMergedOcc 0
30 mol 236 unq 1 iso 0 dist 8.01164 9.05929 10.6351 6.83211 7.34709 8.77254 numMergedOcc 0
31 mol 256 unq 0 iso 0 dist 9.37687 7.67598 9.07441 5.57318 9.7777 10.9861 numMergedOcc 0
32 mol 259 unq 0 iso 0 dist 5.45793 5.90645 6.59107 5.45575 9.29355 10.3594 numMergedOcc 0
33 mol 259 unq 1 iso 0 dist 5.45793 5.90645 6.59107 7.04297 7.87978 11.5101 numMergedOcc 0
34 mol 259 unq 2 iso 0 dist 5.45793 5.90645 6.59107 6.13878 6.13752 6.77279 numMergedOcc 0
35 mol 259 unq 3 iso 0 dist 5.98006 8.06771 5.71237 5.30516 6.13752 10.8647 numMergedOcc 0
36 mol 266 unq 0 iso 0 dist 3.90274 8.12852 5.73592 8.18304 8.14167 13.7449 numMergedOcc 0
