0 mol 1 unq 0 iso 0 dist 7.68779 6.41817 11.8728 7.42008 11.3766 9.76602 7.49891 15.1834 7.83632 9.84669 numMergedOcc 0
1 mol 12 unq 0 iso 0 dist 9.41745 7.4036 10.9547 8.41256 16.299 9.25493 11.6972 17.5245 6.96422 10.3414 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 9.15677 9.53735 10.797 12.1626 9.7522 8.99751 5.19563 12.0096 7.22361 10.7581 numMergedOcc 0
3 mol 26 unq 1 iso 0 dist 9.15677 9.53735 10.797 12.1626 9.7522 8.99751 14.2716 13.2086 6.15893 6.77783 numMergedOcc 0
4 mol 26 unq 2 iso 0 dist 9.15677 9.53735 10.797 14.2372 13.4268 9.30674 5.19563 12.0096 7.22361 11.3546 numMergedOcc 0
5 mol 26 unq 3 iso 0 dist 9.15677 9.53735 10.797 14.2372 13.4268 9.30674 14.2716 13.2086 6.15893 5.24037 numMergedOcc 0
6 mol 26 unq 4 iso 0 dist 9.15677 9.53735 10.797 14.8605 16.1537 8.25567 5.19563 12.0096 7.22361 10.6733 numMergedOcc 0
7 mol 26 unq 5 iso 0 dist 9.15677 9.53735 10.797 14.8605 16.1537 8.25567 14.2716 13.2086 6.15893 4.82659 numMergedOcc 0
8 mol 26 unq 6 iso 0 dist 9.61029 9.34599 10.797 7.53125 9.7522 8.99751 14.7857 12.0096 7.22361 10.7581 numMergedOcc 0
9 mol 26 unq 7 iso 0 dist 9.61029 9.34599 10.797 7.53125 9.7522 8.99751 7.23962 13.2086 6.15893 6.77783 numMergedOcc 0
10 mol 26 unq 8 iso 0 dist 9.61029 9.34599 10.797 9.31749 13.4268 9.30674 14.7857 12.0096 7.22361 11.3546 numMergedOcc 0
11 mol 26 unq 9 iso 0 dist 9.61029 9.34599 10.797 9.31749 13.4268 9.30674 7.23962 13.2086 6.15893 5.24037 numMergedOcc 0
12 mol 26 unq 10 iso 0 dist 9.61029 9.34599 10.797 11.7685 16.1537 8.25567 14.7857 12.0096 7.22361 10.6733 numMergedOcc 0
13 mol 26 unq 11 iso 0 dist 9.61029 9.34599 10.797 11.7685 16.1537 8.25567 7.23962 13.2086 6.15893 4.82659 numMergedOcc 0
14 mol 26 unq 12 iso 0 dist 9.61029 6.32127 10.9837 7.53125 9.7522 9.44507 7.23962 13.2086 5.497 6.77783 numMergedOcc 0
15 mol 27 unq 0 iso 0 dist 8.28463 7.24775 14.3929 12.4614 19.7162 5.66743 3.71754 9.77484 7.60283 11.6846 numMergedOcc 0
16 mol 27 unq 1 iso 0 dist 8.28463 7.24775 14.3929 10.6589 16.4314 7.42669 3.71754 9.77484 7.60283 8.05284 numMergedOcc 0
17 mol 54 unq 0 iso 0 dist 7.51978 5.0478 4.29856 8.88887 5.97635 4.38047 5.59128 5.02241 6.30987 8.98505 numMergedOcc 0
18 mol 61 unq 0 iso 0 dist 8.60577 5.39827 9.23414 7.90807 15.425 6.94677 6.35361 12.7769 7.46994 7.43727 numMergedOcc 0
19 mol 100 unq 0 iso 0 dist 5.09688 8.22984 9.75737 14.6602 18.1028 9.16592 12.1174 14.448 7.09065 7.62048 numMergedOcc 0
20 mol 100 unq 1 iso 0 dist 9.91446 6.6157 7.16919 10.6262 10.9561 9.16592 7.39527 4.76815 7.09065 7.62048 numMergedOcc 0
21 mol 100 unq 2 iso 0 dist 9.26343 6.6157 9.75737 10.6262 18.1028 9.16592 7.39527 14.448 7.09065 7.62048 numMergedOcc 0
22 mol 253 unq 0 iso 0 dist 5.76077 7.06589 5.78064 4.58695 7.15815 9.69704 10.6548 7.19465 9.58354 8.75798 numMergedOcc 0
23 mol 253 unq 1 iso 0 dist 7.0247 8.70383 5.78064 11.088 7.15815 9.69704 3.494 7.19465 9.58354 8.75798 numMergedOcc 0
24 mol 287 unq 0 iso 0 dist 9.22576 9.52718 4.9628 7.88871 11.3387 7.76945 9.81184 9.85934 5.59555 4.26276 numMergedOcc 0
25 mol 288 unq 0 iso 0 dist 9.22576 9.52718 4.9628 7.88871 11.3387 7.76945 9.81184 9.85934 5.59555 4.26276 numMergedOcc 0
26 mol 289 unq 0 iso 0 dist 9.22576 9.52718 4.9628 7.88871 11.3387 7.76945 9.81184 9.85934 5.59555 4.26276 numMergedOcc 0
