0 mol 10 unq 0 iso 0 dist 9.09015 5.24846 9.6309 7.83137 8.76873 4.96625 numMergedOcc 0
1 mol 10 unq 0 iso 1 dist 9.09015 7.83137 8.76873 5.24846 9.6309 4.96625 numMergedOcc 0
2 mol 10 unq 1 iso 0 dist 9.09015 5.24846 9.6309 9.24758 9.58981 10.304 numMergedOcc 0
3 mol 10 unq 1 iso 1 dist 9.09015 9.24758 9.58981 5.24846 9.6309 10.304 numMergedOcc 0
4 mol 10 unq 1 iso 0 dist 9.09015 7.83137 8.76873 9.24758 9.58981 7.00368 numMergedOcc 0
5 mol 10 unq 1 iso 1 dist 9.09015 9.24758 9.58981 7.83137 8.76873 7.00368 numMergedOcc 0
6 mol 10 unq 2 iso 0 dist 7.82815 8.51289 9.6309 3.98499 8.76873 4.96625 numMergedOcc 0
7 mol 10 unq 2 iso 1 dist 7.82815 3.98499 8.76873 8.51289 9.6309 4.96625 numMergedOcc 0
8 mol 10 unq 3 iso 0 dist 7.82815 8.51289 9.6309 4.75951 9.58981 10.304 numMergedOcc 0
9 mol 10 unq 3 iso 1 dist 7.82815 4.75951 9.58981 8.51289 9.6309 10.304 numMergedOcc 0
10 mol 10 unq 3 iso 0 dist 7.82815 3.98499 8.76873 4.75951 9.58981 7.00368 numMergedOcc 0
11 mol 10 unq 3 iso 1 dist 7.82815 4.75951 9.58981 3.98499 8.76873 7.00368 numMergedOcc 0
12 mol 10 unq 4 iso 0 dist 8.37314 4.17235 4.94198 4.60961 8.28764 3.97757 numMergedOcc 0
13 mol 10 unq 4 iso 1 dist 8.37314 4.60961 8.28764 4.17235 4.94198 3.97757 numMergedOcc 0
14 mol 92 unq 0 iso 0 dist 6.35305 10.1005 7.29864 4.01477 6.04223 12.0142 numMergedOcc 0
15 mol 92 unq 0 iso 1 dist 6.35305 4.01477 6.04223 10.1005 7.29864 12.0142 numMergedOcc 0
16 mol 129 unq 0 iso 0 dist 8.42277 8.62597 7.93106 4.04119 7.04904 9.44114 numMergedOcc 0
17 mol 129 unq 0 iso 1 dist 8.42277 4.04119 7.04904 8.62597 7.93106 9.44114 numMergedOcc 0
18 mol 129 unq 1 iso 0 dist 6.26653 8.62597 9.05575 4.04119 5.06053 9.44114 numMergedOcc 0
19 mol 129 unq 1 iso 1 dist 6.26653 4.04119 5.06053 8.62597 9.05575 9.44114 numMergedOcc 0
20 mol 133 unq 0 iso 0 dist 6.01995 7.49664 4.82356 14.1334 8.83476 7.57921 numMergedOcc 0
21 mol 133 unq 0 iso 1 dist 6.01995 14.1334 8.83476 7.49664 4.82356 7.57921 numMergedOcc 0
22 mol 151 unq 0 iso 0 dist 5.91643 4.85702 9.98086 4.18174 8.89982 4.41114 numMergedOcc 0
23 mol 151 unq 0 iso 1 dist 5.91643 4.18174 8.89982 4.85702 9.98086 4.41114 numMergedOcc 0
24 mol 151 unq 1 iso 0 dist 5.91643 4.85702 9.98086 4.20596 6.12972 8.79607 numMergedOcc 0
25 mol 151 unq 1 iso 1 dist 5.91643 4.20596 6.12972 4.85702 9.98086 8.79607 numMergedOcc 0
26 mol 151 unq 1 iso 0 dist 5.91643 4.18174 8.89982 4.20596 6.12972 6.82905 numMergedOcc 0
27 mol 151 unq 1 iso 1 dist 5.91643 4.20596 6.12972 4.18174 8.89982 6.82905 numMergedOcc 0
28 mol 167 unq 0 iso 0 dist 8.0697 11.9696 8.95296 5.37536 6.10021 6.60061 numMergedOcc 0
29 mol 167 unq 0 iso 1 dist 8.0697 5.37536 6.10021 11.9696 8.95296 6.60061 numMergedOcc 0
30 mol 204 unq 0 iso 0 dist 9.38235 3.95188 8.49554 4.92057 8.29256 3.78668 numMergedOcc 0
31 mol 204 unq 0 iso 1 dist 9.38235 4.92057 8.29256 3.95188 8.49554 3.78668 numMergedOcc 0
32 mol 254 unq 0 iso 0 dist 7.94753 4.93882 9.09568 5.60874 7.84221 7.04018 numMergedOcc 0
33 mol 254 unq 0 iso 1 dist 7.94753 5.60874 7.84221 4.93882 9.09568 7.04018 numMergedOcc 0
34 mol 254 unq 1 iso 0 dist 9.99046 4.93882 9.99168 5.60874 9.67383 7.04018 numMergedOcc 0
35 mol 254 unq 1 iso 1 dist 9.99046 5.60874 9.67383 4.93882 9.99168 7.04018 numMergedOcc 0
36 mol 266 unq 0 iso 0 dist 5.28746 7.5048 9.35293 8.13064 7.93375 3.47783 numMergedOcc 0
37 mol 266 unq 0 iso 1 dist 5.28746 8.13064 7.93375 7.5048 9.35293 3.47783 numMergedOcc 0
38 mol 280 unq 0 iso 0 dist 8.6212 4.79056 9.22665 12.0649 9.84708 9.41086 numMergedOcc 0
39 mol 280 unq 0 iso 1 dist 8.6212 12.0649 9.84708 4.79056 9.22665 9.41086 numMergedOcc 0
40 mol 287 unq 0 iso 0 dist 9.03468 6.1412 8.71974 13.2279 8.82649 13.2704 numMergedOcc 0
41 mol 287 unq 0 iso 1 dist 9.03468 13.2279 8.82649 6.1412 8.71974 13.2704 numMergedOcc 0
42 mol 287 unq 1 iso 0 dist 9.03468 6.1412 8.71974 12.5251 7.35776 14.9131 numMergedOcc 0
43 mol 287 unq 1 iso 1 dist 9.03468 12.5251 7.35776 6.1412 8.71974 14.9131 numMergedOcc 0
44 mol 287 unq 1 iso 0 dist 9.03468 13.2279 8.82649 12.5251 7.35776 8.46742 numMergedOcc 0
45 mol 287 unq 1 iso 1 dist 9.03468 12.5251 7.35776 13.2279 8.82649 8.46742 numMergedOcc 0
46 mol 287 unq 2 iso 0 dist 6.05363 11.8278 8.71974 4.22529 8.82649 13.2704 numMergedOcc 0
47 mol 287 unq 2 iso 1 dist 6.05363 4.22529 8.82649 11.8278 8.71974 13.2704 numMergedOcc 0
48 mol 287 unq 3 iso 0 dist 6.05363 11.8278 8.71974 8.19487 7.35776 14.9131 numMergedOcc 0
49 mol 287 unq 3 iso 1 dist 6.05363 8.19487 7.35776 11.8278 8.71974 14.9131 numMergedOcc 0
50 mol 287 unq 3 iso 0 dist 6.05363 4.22529 8.82649 8.19487 7.35776 8.46742 numMergedOcc 0
51 mol 287 unq 3 iso 1 dist 6.05363 8.19487 7.35776 4.22529 8.82649 8.46742 numMergedOcc 0
52 mol 288 unq 0 iso 0 dist 9.03468 6.1412 8.71974 13.2279 8.82649 13.2704 numMergedOcc 0
53 mol 288 unq 0 iso 1 dist 9.03468 13.2279 8.82649 6.1412 8.71974 13.2704 numMergedOcc 0
54 mol 288 unq 1 iso 0 dist 9.03468 6.1412 8.71974 12.5251 7.35776 14.9131 numMergedOcc 0
55 mol 288 unq 1 iso 1 dist 9.03468 12.5251 7.35776 6.1412 8.71974 14.9131 numMergedOcc 0
56 mol 288 unq 1 iso 0 dist 9.03468 13.2279 8.82649 12.5251 7.35776 8.46742 numMergedOcc 0
57 mol 288 unq 1 iso 1 dist 9.03468 12.5251 7.35776 13.2279 8.82649 8.46742 numMergedOcc 0
58 mol 288 unq 2 iso 0 dist 6.05363 11.8278 8.71974 4.22529 8.82649 13.2704 numMergedOcc 0
59 mol 288 unq 2 iso 1 dist 6.05363 4.22529 8.82649 11.8278 8.71974 13.2704 numMergedOcc 0
60 mol 288 unq 3 iso 0 dist 6.05363 11.8278 8.71974 8.19487 7.35776 14.9131 numMergedOcc 0
61 mol 288 unq 3 iso 1 dist 6.05363 8.19487 7.35776 11.8278 8.71974 14.9131 numMergedOcc 0
62 mol 288 unq 3 iso 0 dist 6.05363 4.22529 8.82649 8.19487 7.35776 8.46742 numMergedOcc 0
63 mol 288 unq 3 iso 1 dist 6.05363 8.19487 7.35776 4.22529 8.82649 8.46742 numMergedOcc 0
64 mol 289 unq 0 iso 0 dist 9.03468 6.1412 8.71974 13.2279 8.82649 13.2704 numMergedOcc 0
65 mol 289 unq 0 iso 1 dist 9.03468 13.2279 8.82649 6.1412 8.71974 13.2704 numMergedOcc 0
66 mol 289 unq 1 iso 0 dist 9.03468 6.1412 8.71974 12.5251 7.35776 14.9131 numMergedOcc 0
67 mol 289 unq 1 iso 1 dist 9.03468 12.5251 7.35776 6.1412 8.71974 14.9131 numMergedOcc 0
68 mol 289 unq 1 iso 0 dist 9.03468 13.2279 8.82649 12.5251 7.35776 8.46742 numMergedOcc 0
69 mol 289 unq 1 iso 1 dist 9.03468 12.5251 7.35776 13.2279 8.82649 8.46742 numMergedOcc 0
70 mol 289 unq 2 iso 0 dist 6.05363 11.8278 8.71974 4.22529 8.82649 13.2704 numMergedOcc 0
71 mol 289 unq 2 iso 1 dist 6.05363 4.22529 8.82649 11.8278 8.71974 13.2704 numMergedOcc 0
72 mol 289 unq 3 iso 0 dist 6.05363 11.8278 8.71974 8.19487 7.35776 14.9131 numMergedOcc 0
73 mol 289 unq 3 iso 1 dist 6.05363 8.19487 7.35776 11.8278 8.71974 14.9131 numMergedOcc 0
74 mol 289 unq 3 iso 0 dist 6.05363 4.22529 8.82649 8.19487 7.35776 8.46742 numMergedOcc 0
75 mol 289 unq 3 iso 1 dist 6.05363 8.19487 7.35776 4.22529 8.82649 8.46742 numMergedOcc 0
