0 mol 25 unq 0 iso 0 dist 6.34277 5.3503 9.40763 5.55893 5.04899 6.7276 numMergedOcc 0
1 mol 25 unq 0 iso 1 dist 9.40763 5.3503 6.34277 6.7276 5.04899 5.55893 numMergedOcc 0
2 mol 52 unq 0 iso 0 dist 9.6112 5.76713 6.08894 9.99897 7.34143 6.01116 numMergedOcc 0
3 mol 52 unq 0 iso 1 dist 6.08894 5.76713 9.6112 6.01116 7.34143 9.99897 numMergedOcc 0
4 mol 52 unq 1 iso 0 dist 9.6112 10.9302 9.02308 9.99897 7.34143 4.98024 numMergedOcc 0
5 mol 52 unq 1 iso 1 dist 9.02308 10.9302 9.6112 4.98024 7.34143 9.99897 numMergedOcc 0
6 mol 52 unq 1 iso 0 dist 6.08894 5.72338 9.02308 6.01116 7.34143 4.98024 numMergedOcc 0
7 mol 52 unq 1 iso 1 dist 9.02308 5.72338 6.08894 4.98024 7.34143 6.01116 numMergedOcc 0
8 mol 129 unq 0 iso 0 dist 6.1421 8.54232 9.54663 7.86921 8.54584 6.95124 numMergedOcc 0
9 mol 129 unq 0 iso 1 dist 9.54663 8.54232 6.1421 6.95124 8.54584 7.86921 numMergedOcc 0
10 mol 180 unq 0 iso 0 dist 7.24785 5.28424 7.53287 14.0966 9.62337 14.0344 numMergedOcc 0
11 mol 180 unq 0 iso 1 dist 7.53287 5.28424 7.24785 14.0344 9.62337 14.0966 numMergedOcc 0
12 mol 197 unq 0 iso 0 dist 9.00273 8.99694 7.19387 12.3192 8.56633 11.7609 numMergedOcc 0
13 mol 197 unq 0 iso 1 dist 7.19387 8.99694 9.00273 11.7609 8.56633 12.3192 numMergedOcc 0
14 mol 204 unq 0 iso 0 dist 9.65951 7.99053 9.14829 11.5989 7.10633 6.73339 numMergedOcc 0
15 mol 204 unq 0 iso 1 dist 9.14829 7.99053 9.65951 6.73339 7.10633 11.5989 numMergedOcc 0
16 mol 204 unq 1 iso 0 dist 9.65951 7.99053 9.14829 9.99471 8.51516 13.2127 numMergedOcc 0
17 mol 204 unq 1 iso 1 dist 9.14829 7.99053 9.65951 13.2127 8.51516 9.99471 numMergedOcc 0
18 mol 234 unq 0 iso 0 dist 8.58958 11.2933 9.70004 16.0172 8.34494 10.9359 numMergedOcc 0
19 mol 234 unq 0 iso 1 dist 9.70004 11.2933 8.58958 10.9359 8.34494 16.0172 numMergedOcc 0
20 mol 234 unq 1 iso 0 dist 8.58958 11.2933 9.70004 14.7629 6.56247 14.3229 numMergedOcc 0
21 mol 234 unq 1 iso 1 dist 9.70004 11.2933 8.58958 14.3229 6.56247 14.7629 numMergedOcc 0
22 mol 234 unq 2 iso 0 dist 8.58958 11.2933 9.70004 13.5847 9.36357 17.5883 numMergedOcc 0
23 mol 234 unq 2 iso 1 dist 9.70004 11.2933 8.58958 17.5883 9.36357 13.5847 numMergedOcc 0
24 mol 264 unq 0 iso 0 dist 6.20796 5.73422 7.73693 6.9758 9.17653 5.00433 numMergedOcc 0
25 mol 264 unq 0 iso 1 dist 7.73693 5.73422 6.20796 5.00433 9.17653 6.9758 numMergedOcc 0
26 mol 276 unq 0 iso 0 dist 6.97104 4.24907 8.63281 12.2532 9.8993 12.388 numMergedOcc 0
27 mol 276 unq 0 iso 1 dist 8.63281 4.24907 6.97104 12.388 9.8993 12.2532 numMergedOcc 0
28 mol 276 unq 1 iso 0 dist 6.97104 4.24907 8.63281 5.58984 6.87396 6.58819 numMergedOcc 0
29 mol 276 unq 1 iso 1 dist 8.63281 4.24907 6.97104 6.58819 6.87396 5.58984 numMergedOcc 0
30 mol 277 unq 0 iso 0 dist 6.86014 10.7983 5.97073 4.83355 9.7748 11.2857 numMergedOcc 0
31 mol 277 unq 0 iso 1 dist 5.97073 10.7983 6.86014 11.2857 9.7748 4.83355 numMergedOcc 0
32 mol 277 unq 1 iso 0 dist 6.86014 12.8545 6.49176 4.83355 9.7748 14.4976 numMergedOcc 0
33 mol 277 unq 1 iso 1 dist 6.49176 12.8545 6.86014 14.4976 9.7748 4.83355 numMergedOcc 0
34 mol 277 unq 1 iso 0 dist 5.97073 5.3634 6.49176 11.2857 9.7748 14.4976 numMergedOcc 0
35 mol 277 unq 1 iso 1 dist 6.49176 5.3634 5.97073 14.4976 9.7748 11.2857 numMergedOcc 0
36 mol 292 unq 0 iso 0 dist 6.87804 12.3032 6.07571 11.634 8.2734 8.66797 numMergedOcc 0
37 mol 292 unq 0 iso 1 dist 6.07571 12.3032 6.87804 8.66797 8.2734 11.634 numMergedOcc 0
