0 mol 18 unq 0 iso 0 dist 6.41856 5.03976 5.01478 5.02571 11.1019 8.52106 numMergedOcc 0
1 mol 18 unq 1 iso 0 dist 6.41856 5.03976 5.01478 6.78812 10.5792 6.32451 numMergedOcc 0
2 mol 18 unq 2 iso 0 dist 8.51213 5.03976 7.04695 5.02571 11.103 8.52106 numMergedOcc 0
3 mol 18 unq 3 iso 0 dist 8.51213 5.03976 7.04695 6.78812 9.94539 6.32451 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 7.34549 9.08976 11.887 13.1105 18.9645 8.82012 numMergedOcc 0
5 mol 26 unq 1 iso 0 dist 7.34549 9.08976 11.887 4.76147 8.34347 9.16962 numMergedOcc 0
6 mol 113 unq 0 iso 0 dist 9.57352 6.32393 8.69934 10.8558 15.0169 6.81812 numMergedOcc 0
7 mol 117 unq 0 iso 0 dist 9.60425 9.77482 11.3679 5.17524 9.84395 6.62561 numMergedOcc 0
8 mol 117 unq 1 iso 0 dist 9.60425 9.77482 11.3679 10.7342 16.5575 7.63616 numMergedOcc 0
9 mol 117 unq 2 iso 0 dist 9.60425 9.0428 15.2823 6.3368 15.5207 7.20326 numMergedOcc 0
10 mol 147 unq 0 iso 0 dist 9.23551 4.48898 8.54341 6.97147 14.5625 8.33261 numMergedOcc 0
11 mol 181 unq 0 iso 0 dist 9.50454 7.82604 8.93318 5.49666 14.4936 9.6668 numMergedOcc 0
12 mol 181 unq 1 iso 0 dist 9.50454 8.22583 9.60512 11.755 7.63312 7.98142 numMergedOcc 0
13 mol 181 unq 2 iso 0 dist 7.15963 7.82604 8.25067 5.49666 9.15386 9.6668 numMergedOcc 0
14 mol 181 unq 3 iso 0 dist 7.15963 8.22583 14.8479 11.755 16.9324 7.98142 numMergedOcc 0
15 mol 205 unq 0 iso 0 dist 6.04106 9.70674 6.23291 12.9245 7.26832 9.19704 numMergedOcc 0
16 mol 220 unq 0 iso 0 dist 9.23844 5.02756 5.21956 5.74363 12.9375 7.82944 numMergedOcc 0
17 mol 234 unq 0 iso 0 dist 4.91961 6.553 5.56749 12.2372 10.3625 6.16063 numMergedOcc 0
18 mol 234 unq 1 iso 0 dist 7.14333 6.553 8.0608 12.2372 11.0622 6.16063 numMergedOcc 0
19 mol 238 unq 0 iso 0 dist 8.39522 6.59305 6.20606 4.88998 6.57393 5.38637 numMergedOcc 0
20 mol 238 unq 1 iso 0 dist 8.39522 6.59305 6.20606 5.87189 11.101 6.55759 numMergedOcc 0
21 mol 238 unq 2 iso 0 dist 5.99187 6.59305 10.4664 4.88998 10.0756 5.38637 numMergedOcc 0
22 mol 238 unq 3 iso 0 dist 5.99187 6.59305 10.4664 5.87189 7.31233 6.55759 numMergedOcc 0
23 mol 238 unq 4 iso 0 dist 9.93378 6.59305 13.3539 4.88998 14.6071 5.38637 numMergedOcc 0
24 mol 238 unq 5 iso 0 dist 9.93378 6.59305 13.3539 5.87189 13.1583 6.55759 numMergedOcc 0
25 mol 259 unq 0 iso 0 dist 8.69345 5.68415 5.20486 9.03495 11.5135 6.77938 numMergedOcc 0
26 mol 265 unq 0 iso 0 dist 6.78702 7.74463 6.43013 4.75685 8.4218 6.34034 numMergedOcc 0
27 mol 267 unq 0 iso 0 dist 6.19138 9.18446 6.45566 14.0558 14.4611 8.76007 numMergedOcc 0
28 mol 267 unq 1 iso 0 dist 6.54381 6.60591 6.45566 10.3309 14.4611 8.76007 numMergedOcc 0
