0 mol 10 unq 0 iso 0 dist 6.50444 6.23648 7.14537 4.87706 9.39486 7.92569 numMergedOcc 0
1 mol 10 unq 0 iso 1 dist 6.50444 4.87706 9.39486 6.23648 7.14537 7.92569 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 8.94703 6.58064 8.69288 6.40447 7.77964 4.4275 numMergedOcc 0
3 mol 24 unq 0 iso 1 dist 8.94703 6.40447 7.77964 6.58064 8.69288 4.4275 numMergedOcc 0
4 mol 25 unq 0 iso 0 dist 5.77745 5.23233 8.07318 6.29702 7.44277 9.7883 numMergedOcc 0
5 mol 25 unq 0 iso 1 dist 5.77745 6.29702 7.44277 5.23233 8.07318 9.7883 numMergedOcc 0
6 mol 30 unq 0 iso 0 dist 5.14358 4.61651 7.27243 5.34619 8.23784 3.56854 numMergedOcc 0
7 mol 30 unq 0 iso 1 dist 5.14358 5.34619 8.23784 4.61651 7.27243 3.56854 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 9.762 10.8441 8.46627 15.2203 9.22208 5.30471 numMergedOcc 0
9 mol 73 unq 0 iso 1 dist 9.762 15.2203 9.22208 10.8441 8.46627 5.30471 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 9.18289 5.33968 5.67168 10.1509 7.74579 5.14122 numMergedOcc 0
11 mol 186 unq 0 iso 1 dist 9.18289 10.1509 7.74579 5.33968 5.67168 5.14122 numMergedOcc 0
12 mol 186 unq 1 iso 0 dist 9.18289 5.33968 5.67168 10.9974 5.86483 6.05141 numMergedOcc 0
13 mol 186 unq 1 iso 1 dist 9.18289 10.9974 5.86483 5.33968 5.67168 6.05141 numMergedOcc 0
14 mol 186 unq 1 iso 0 dist 9.18289 10.1509 7.74579 10.9974 5.86483 3.51591 numMergedOcc 0
15 mol 186 unq 1 iso 1 dist 9.18289 10.9974 5.86483 10.1509 7.74579 3.51591 numMergedOcc 0
16 mol 206 unq 0 iso 0 dist 8.79378 9.39446 9.95026 6.98142 9.09594 3.96868 numMergedOcc 0
17 mol 206 unq 0 iso 1 dist 8.79378 6.98142 9.09594 9.39446 9.95026 3.96868 numMergedOcc 0
18 mol 222 unq 0 iso 0 dist 8.86886 4.91709 8.14294 5.96186 5.72 3.58181 numMergedOcc 0
19 mol 222 unq 0 iso 1 dist 8.86886 5.96186 5.72 4.91709 8.14294 3.58181 numMergedOcc 0
20 mol 222 unq 1 iso 0 dist 8.86886 4.91709 8.14294 9.55743 6.84052 8.23638 numMergedOcc 0
21 mol 222 unq 1 iso 1 dist 8.86886 9.55743 6.84052 4.91709 8.14294 8.23638 numMergedOcc 0
22 mol 222 unq 1 iso 0 dist 8.86886 5.96186 5.72 9.55743 6.84052 4.79329 numMergedOcc 0
23 mol 222 unq 1 iso 1 dist 8.86886 9.55743 6.84052 5.96186 5.72 4.79329 numMergedOcc 0
24 mol 225 unq 0 iso 0 dist 9.49163 12.7552 9.3502 5.69755 9.34821 11.1622 numMergedOcc 0
25 mol 225 unq 0 iso 1 dist 9.49163 5.69755 9.34821 12.7552 9.3502 11.1622 numMergedOcc 0
26 mol 225 unq 1 iso 0 dist 9.49163 12.7552 9.3502 12.7092 6.46405 8.90802 numMergedOcc 0
27 mol 225 unq 1 iso 1 dist 9.49163 12.7092 6.46405 12.7552 9.3502 8.90802 numMergedOcc 0
28 mol 225 unq 1 iso 0 dist 9.49163 5.69755 9.34821 12.7092 6.46405 9.25318 numMergedOcc 0
29 mol 225 unq 1 iso 1 dist 9.49163 12.7092 6.46405 5.69755 9.34821 9.25318 numMergedOcc 0
30 mol 225 unq 2 iso 0 dist 9.99149 14.0407 9.3502 3.90755 9.34821 11.1622 numMergedOcc 0
31 mol 225 unq 2 iso 1 dist 9.99149 3.90755 9.34821 14.0407 9.3502 11.1622 numMergedOcc 0
32 mol 225 unq 3 iso 0 dist 9.99149 14.0407 9.3502 11.662 6.46405 8.90802 numMergedOcc 0
33 mol 225 unq 3 iso 1 dist 9.99149 11.662 6.46405 14.0407 9.3502 8.90802 numMergedOcc 0
34 mol 225 unq 3 iso 0 dist 9.99149 3.90755 9.34821 11.662 6.46405 9.25318 numMergedOcc 0
35 mol 225 unq 3 iso 1 dist 9.99149 11.662 6.46405 3.90755 9.34821 9.25318 numMergedOcc 0
36 mol 279 unq 0 iso 0 dist 7.37488 6.32559 5.02349 4.53305 9.19322 8.02622 numMergedOcc 0
37 mol 279 unq 0 iso 1 dist 7.37488 4.53305 9.19322 6.32559 5.02349 8.02622 numMergedOcc 0
38 mol 279 unq 1 iso 0 dist 8.7503 7.93887 5.02349 9.84272 9.19322 8.02622 numMergedOcc 0
39 mol 279 unq 1 iso 1 dist 8.7503 9.84272 9.19322 7.93887 5.02349 8.02622 numMergedOcc 0
40 mol 292 unq 0 iso 0 dist 7.78796 7.45665 6.22943 7.02045 9.31056 5.99377 numMergedOcc 0
41 mol 292 unq 0 iso 1 dist 7.78796 7.02045 9.31056 7.45665 6.22943 5.99377 numMergedOcc 0
