0 mol 19 unq 0 iso 0 dist 8.18518 14.1404 8.4674 19.8807 13.3276 6.41045 12.9091 5.80928 4.51865 7.64353 numMergedOcc 0
1 mol 60 unq 0 iso 0 dist 8.8058 12.5818 6.43294 13.5307 4.80738 7.15352 17.8366 10.6819 6.65595 9.28444 numMergedOcc 0
2 mol 60 unq 1 iso 0 dist 8.8058 12.5818 6.43294 13.5307 4.80738 7.15352 17.4408 11.3621 9.25011 11.0491 numMergedOcc 0
3 mol 60 unq 2 iso 0 dist 8.8058 12.5818 6.43294 13.5307 4.80738 7.15352 12.1949 5.51199 8.52121 6.28337 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 6.30194 10.5627 6.19304 13.1329 9.59988 7.23812 10.392 5.4148 9.96396 12.8453 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 6.30194 10.5627 6.19304 13.1329 9.59988 7.23812 18.5427 13.3558 8.70481 7.80518 numMergedOcc 0
6 mol 73 unq 2 iso 0 dist 5.79954 12.8388 9.96396 16.1485 12.8453 7.23812 10.4766 5.4148 6.19304 9.59988 numMergedOcc 0
7 mol 73 unq 3 iso 0 dist 5.79954 12.8388 9.96396 16.1485 12.8453 7.23812 15.4777 14.9342 8.70481 7.80518 numMergedOcc 0
8 mol 73 unq 4 iso 0 dist 7.01889 15.0744 9.96396 14.8021 12.8453 7.23812 10.997 5.4148 6.19304 9.59988 numMergedOcc 0
9 mol 73 unq 5 iso 0 dist 7.01889 15.0744 9.96396 14.8021 12.8453 7.23812 17.1639 14.9342 8.70481 7.80518 numMergedOcc 0
10 mol 75 unq 0 iso 0 dist 7.16583 6.77761 7.79912 14.9906 14.2474 9.20448 11.6681 5.64643 8.56639 12.103 numMergedOcc 0
11 mol 75 unq 1 iso 0 dist 7.16583 6.77761 7.79912 14.9906 14.2474 9.20448 13.9013 10.4899 8.59017 5.76778 numMergedOcc 0
12 mol 75 unq 2 iso 0 dist 7.16583 6.77761 7.79912 12.7532 13.8905 6.96759 11.6681 5.64643 8.56639 12.899 numMergedOcc 0
13 mol 75 unq 3 iso 0 dist 7.16583 6.77761 7.79912 12.7532 13.8905 6.96759 13.9013 10.4899 8.59017 8.41332 numMergedOcc 0
14 mol 75 unq 4 iso 0 dist 7.16583 6.77761 7.79912 11.1485 11.2774 6.97318 11.6681 5.64643 8.56639 11.0206 numMergedOcc 0
15 mol 75 unq 5 iso 0 dist 7.16583 6.77761 7.79912 11.1485 11.2774 6.97318 13.9013 10.4899 8.59017 6.56982 numMergedOcc 0
16 mol 75 unq 6 iso 0 dist 7.118 5.06305 7.79912 13.5859 14.2474 9.20448 8.24814 5.64643 8.56639 12.103 numMergedOcc 0
17 mol 75 unq 7 iso 0 dist 7.118 5.06305 7.79912 13.5859 14.2474 9.20448 11.548 10.4899 8.59017 5.76778 numMergedOcc 0
18 mol 75 unq 8 iso 0 dist 7.118 5.06305 7.79912 11.514 13.8905 6.96759 8.24814 5.64643 8.56639 12.899 numMergedOcc 0
19 mol 75 unq 9 iso 0 dist 7.118 5.06305 7.79912 11.514 13.8905 6.96759 11.548 10.4899 8.59017 8.41332 numMergedOcc 0
20 mol 75 unq 10 iso 0 dist 7.118 5.06305 7.79912 11.8337 11.2774 6.97318 8.24814 5.64643 8.56639 11.0206 numMergedOcc 0
21 mol 75 unq 11 iso 0 dist 7.118 5.06305 7.79912 11.8337 11.2774 6.97318 11.548 10.4899 8.59017 6.56982 numMergedOcc 0
22 mol 75 unq 12 iso 0 dist 8.24814 5.06305 8.56639 13.5859 12.103 9.20448 7.118 5.64643 7.79912 14.2474 numMergedOcc 0
23 mol 75 unq 13 iso 0 dist 8.24814 5.06305 8.56639 13.5859 12.103 9.20448 11.548 7.00674 8.59017 5.76778 numMergedOcc 0
24 mol 75 unq 14 iso 0 dist 8.24814 5.06305 8.56639 11.514 12.899 6.96759 7.118 5.64643 7.79912 13.8905 numMergedOcc 0
25 mol 75 unq 15 iso 0 dist 8.24814 5.06305 8.56639 11.514 12.899 6.96759 11.548 7.00674 8.59017 8.41332 numMergedOcc 0
26 mol 75 unq 16 iso 0 dist 8.24814 5.06305 8.56639 11.8337 11.0206 6.97318 7.118 5.64643 7.79912 11.2774 numMergedOcc 0
27 mol 75 unq 17 iso 0 dist 8.24814 5.06305 8.56639 11.8337 11.0206 6.97318 11.548 7.00674 8.59017 6.56982 numMergedOcc 0
28 mol 85 unq 0 iso 0 dist 9.22376 3.85308 7.66905 12.4413 15.3279 9.67557 11.7729 10.7229 7.95579 6.53819 numMergedOcc 0
29 mol 85 unq 1 iso 0 dist 9.22376 3.85308 7.66905 12.4413 15.3279 9.67557 9.8682 6.9948 6.19965 9.9705 numMergedOcc 0
30 mol 95 unq 0 iso 0 dist 8.26838 15.4217 8.03644 24.5741 16.4832 9.64673 15.3713 8.41707 7.27724 12.0894 numMergedOcc 0
31 mol 224 unq 0 iso 0 dist 7.25658 5.38198 6.65832 11.2809 4.46743 8.80858 10.8312 6.77699 6.60589 4.93626 numMergedOcc 0
32 mol 224 unq 1 iso 0 dist 7.25658 5.38198 6.65832 11.2809 4.46743 8.80858 11.1589 11.328 9.16166 11.8641 numMergedOcc 0
33 mol 236 unq 0 iso 0 dist 9.97357 4.88785 6.84306 10.2831 5.03564 6.61371 6.36941 7.28249 7.68742 9.63949 numMergedOcc 0
34 mol 236 unq 1 iso 0 dist 9.97357 10.2557 9.99038 8.63249 13.6195 5.90804 6.36941 7.28249 6.27581 7.45579 numMergedOcc 0
35 mol 236 unq 2 iso 0 dist 6.36941 4.88785 7.68742 10.2831 9.63949 6.61371 9.97357 7.28249 6.84306 5.03564 numMergedOcc 0
36 mol 236 unq 3 iso 0 dist 6.36941 10.2557 6.27581 8.63249 7.45579 5.90804 9.97357 7.28249 9.99038 13.6195 numMergedOcc 0
37 mol 253 unq 0 iso 0 dist 7.80525 4.84708 7.32223 11.6315 5.32928 8.82388 7.71295 7.25988 8.31064 9.65021 numMergedOcc 0
38 mol 253 unq 1 iso 0 dist 7.71295 4.84708 8.31064 11.6315 9.65021 8.82388 7.80525 7.25988 7.32223 5.32928 numMergedOcc 0
39 mol 258 unq 0 iso 0 dist 7.9357 8.73372 6.42289 11.866 5.90131 9.04358 13.7159 7.26417 6.60405 8.81588 numMergedOcc 0
40 mol 258 unq 1 iso 0 dist 8.81059 9.78068 6.42289 8.10903 5.90131 9.04358 14.0712 7.26417 6.60405 8.81588 numMergedOcc 0
41 mol 261 unq 0 iso 0 dist 7.15785 6.5875 8.02547 11.1109 9.40373 5.00128 13.1629 10.0727 8.43057 5.09097 numMergedOcc 0
42 mol 261 unq 1 iso 0 dist 7.15785 6.5875 8.02547 11.1109 9.40373 5.00128 9.43169 5.51688 6.05727 4.86901 numMergedOcc 0
43 mol 261 unq 2 iso 0 dist 7.15785 6.5875 8.02547 10.5606 10.3517 6.58604 13.1629 10.0727 8.43057 11.9784 numMergedOcc 0
44 mol 261 unq 3 iso 0 dist 7.15785 6.5875 8.02547 10.5606 10.3517 6.58604 9.43169 5.51688 6.05727 9.47323 numMergedOcc 0
45 mol 261 unq 4 iso 0 dist 7.15785 6.5875 8.02547 8.88741 6.43209 7.30472 13.1629 10.0727 8.43057 11.6843 numMergedOcc 0
46 mol 261 unq 5 iso 0 dist 7.15785 6.5875 8.02547 8.88741 6.43209 7.30472 9.43169 5.51688 6.05727 7.78464 numMergedOcc 0
47 mol 261 unq 6 iso 0 dist 9.43169 6.5875 6.05727 11.1109 4.86901 5.00128 7.15785 5.51688 8.02547 9.40373 numMergedOcc 0
48 mol 261 unq 7 iso 0 dist 9.43169 6.5875 6.05727 11.1109 4.86901 5.00128 13.1629 4.63549 8.43057 5.09097 numMergedOcc 0
49 mol 261 unq 8 iso 0 dist 9.43169 6.5875 6.05727 10.5606 9.47323 6.58604 7.15785 5.51688 8.02547 10.3517 numMergedOcc 0
50 mol 261 unq 9 iso 0 dist 9.43169 6.5875 6.05727 10.5606 9.47323 6.58604 13.1629 4.63549 8.43057 11.9784 numMergedOcc 0
51 mol 261 unq 10 iso 0 dist 9.43169 6.5875 6.05727 8.88741 7.78464 7.30472 7.15785 5.51688 8.02547 6.43209 numMergedOcc 0
52 mol 261 unq 11 iso 0 dist 9.43169 6.5875 6.05727 8.88741 7.78464 7.30472 13.1629 4.63549 8.43057 11.6843 numMergedOcc 0
53 mol 282 unq 0 iso 0 dist 8.58671 8.13794 8.04483 11.0423 5.86383 7.71088 14.7737 10.0156 8.76532 11.2986 numMergedOcc 0
54 mol 282 unq 1 iso 0 dist 8.58671 8.13794 8.04483 11.0423 5.86383 7.71088 11.0247 5.39891 6.33524 7.46064 numMergedOcc 0
55 mol 282 unq 2 iso 0 dist 6.84554 9.67023 8.76532 15.7481 11.2986 7.71088 14.1723 10.0156 8.04483 5.86383 numMergedOcc 0
56 mol 282 unq 3 iso 0 dist 6.84554 9.67023 8.76532 15.7481 11.2986 7.71088 9.51581 4.66602 6.33524 7.46064 numMergedOcc 0
57 mol 282 unq 4 iso 0 dist 9.51581 9.67023 6.33524 15.7481 7.46064 7.71088 14.1723 5.39891 8.04483 5.86383 numMergedOcc 0
58 mol 282 unq 5 iso 0 dist 9.51581 9.67023 6.33524 15.7481 7.46064 7.71088 6.84554 4.66602 8.76532 11.2986 numMergedOcc 0
