0 mol 62 unq 0 iso 0 dist 8.1599 6.35779 5.9487 5.46563 6.9103 9.19512 numMergedOcc 0
1 mol 67 unq 0 iso 0 dist 9.46247 8.4702 4.04753 3.77705 8.3733 5.88409 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 7.51075 5.57551 10.6721 6.56256 7.39665 8.19932 numMergedOcc 0
3 mol 69 unq 0 iso 0 dist 8.91902 9.56859 13.2678 11.7024 14.8691 9.08745 numMergedOcc 0
4 mol 69 unq 1 iso 0 dist 5.47319 5.75135 8.67853 4.69809 5.99857 9.08745 numMergedOcc 0
5 mol 69 unq 2 iso 0 dist 9.8809 5.75135 10.8149 4.69809 6.9362 9.08745 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 6.4551 6.46582 3.69293 11.3491 10.2456 9.57759 numMergedOcc 0
7 mol 81 unq 0 iso 0 dist 9.08307 9.53663 9.42402 7.58448 13.9075 8.96045 numMergedOcc 0
8 mol 101 unq 0 iso 0 dist 5.22543 6.67863 6.2696 13.2642 15.1063 9.33112 numMergedOcc 0
9 mol 113 unq 0 iso 0 dist 8.89481 9.86767 13.0914 7.09333 8.80934 4.30875 numMergedOcc 0
10 mol 120 unq 0 iso 0 dist 7.04864 8.03124 3.35803 4.22448 9.85307 9.98772 numMergedOcc 0
11 mol 169 unq 0 iso 0 dist 9.46833 7.50458 13.9883 6.22697 12.9994 7.65903 numMergedOcc 0
12 mol 169 unq 1 iso 0 dist 9.46833 5.79554 14.8937 6.22697 12.9994 5.97653 numMergedOcc 0
13 mol 169 unq 2 iso 0 dist 9.46833 4.22003 13.4235 6.22697 12.9994 7.75523 numMergedOcc 0
14 mol 176 unq 0 iso 0 dist 8.06326 9.09554 4.17275 3.94408 10.4734 9.9109 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 8.96988 6.99587 9.14919 3.6848 8.90571 9.17458 numMergedOcc 0
16 mol 186 unq 1 iso 0 dist 8.96988 6.99587 9.14919 5.33968 12.3127 6.94594 numMergedOcc 0
17 mol 186 unq 2 iso 0 dist 8.96988 4.37577 9.11577 3.6848 8.90571 7.36794 numMergedOcc 0
18 mol 186 unq 3 iso 0 dist 8.96988 4.37577 9.11577 5.33968 12.3127 5.81881 numMergedOcc 0
19 mol 205 unq 0 iso 0 dist 6.752 8.93485 5.42503 6.10058 8.95122 7.68686 numMergedOcc 0
20 mol 205 unq 1 iso 0 dist 8.10287 5.66636 4.69695 3.50446 8.4844 7.68686 numMergedOcc 0
21 mol 205 unq 2 iso 0 dist 5.4913 5.66636 5.42503 3.50446 8.95122 7.68686 numMergedOcc 0
22 mol 222 unq 0 iso 0 dist 7.85877 4.90656 8.89157 4.91709 5.56538 8.88902 numMergedOcc 0
