0 mol 25 unq 0 iso 0 dist 9.58408 9.07927 16.653 12.3669 21.7338 9.87281 numMergedOcc 0
1 mol 25 unq 1 iso 0 dist 9.58408 8.50987 16.4918 12.3669 21.7338 7.63928 numMergedOcc 0
2 mol 51 unq 0 iso 0 dist 9.50768 5.67627 5.82783 5.46557 12.5561 7.12423 numMergedOcc 0
3 mol 131 unq 0 iso 0 dist 8.91629 6.44766 5.29825 11.2112 7.46875 7.81337 numMergedOcc 0
4 mol 180 unq 0 iso 0 dist 7.11542 7.24785 6.93557 16.5686 15.8981 9.88732 numMergedOcc 0
5 mol 180 unq 1 iso 0 dist 7.11542 7.24785 6.93557 11.9699 11.2584 5.77949 numMergedOcc 0
6 mol 180 unq 2 iso 0 dist 7.11542 7.24785 6.93557 14.8912 12.4704 8.68403 numMergedOcc 0
7 mol 180 unq 3 iso 0 dist 7.11542 7.24785 6.93557 4.80648 9.19555 5.80441 numMergedOcc 0
8 mol 180 unq 4 iso 0 dist 6.43834 7.53287 6.93557 15.4961 15.8981 9.88732 numMergedOcc 0
9 mol 180 unq 5 iso 0 dist 6.43834 7.53287 6.93557 10.2233 11.2584 5.77949 numMergedOcc 0
10 mol 180 unq 6 iso 0 dist 6.43834 7.53287 6.93557 12.1751 12.4704 8.68403 numMergedOcc 0
11 mol 180 unq 7 iso 0 dist 6.43834 7.53287 6.93557 5.28726 9.19555 5.80441 numMergedOcc 0
12 mol 220 unq 0 iso 0 dist 6.99973 5.07968 6.81956 6.85536 12.1747 7.16386 numMergedOcc 0
13 mol 222 unq 0 iso 0 dist 8.27605 8.81925 11.2593 9.27187 15.7405 9.55777 numMergedOcc 0
14 mol 229 unq 0 iso 0 dist 7.68999 9.68636 5.65373 12.8446 13.0602 8.6537 numMergedOcc 0
15 mol 234 unq 0 iso 0 dist 8.70264 7.17987 7.54044 14.3029 11.7673 7.86368 numMergedOcc 0
16 mol 238 unq 0 iso 0 dist 9.8444 9.94587 5.33697 5.6925 9.18345 6.24928 numMergedOcc 0
17 mol 238 unq 1 iso 0 dist 9.73405 9.94587 17.5803 5.6925 13.9474 6.24928 numMergedOcc 0
18 mol 271 unq 0 iso 0 dist 7.88092 7.59727 5.31774 3.76546 8.54162 9.56149 numMergedOcc 0
19 mol 279 unq 0 iso 0 dist 9.65416 9.60619 5.31331 15.5414 12.0665 7.74162 numMergedOcc 0
20 mol 292 unq 0 iso 0 dist 8.85233 6.07571 9.38462 11.4534 15.0526 9.20416 numMergedOcc 0
21 mol 292 unq 1 iso 0 dist 8.85233 6.07571 9.38462 4.49811 7.40069 7.53641 numMergedOcc 0
22 mol 292 unq 2 iso 0 dist 7.06322 6.07571 5.81799 11.4534 14.5129 9.20416 numMergedOcc 0
23 mol 292 unq 3 iso 0 dist 7.06322 6.07571 5.81799 4.49811 10.7581 7.53641 numMergedOcc 0
