0 mol 24 unq 0 iso 0 dist 6.80849 6.08283 8.09311 6.99919 9.05357 9.95274 numMergedOcc 0
1 mol 24 unq 0 iso 1 dist 6.80849 6.99919 9.05357 6.08283 8.09311 9.95274 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 6.00307 3.8857 4.79873 11.2808 9.48085 12.7147 numMergedOcc 0
3 mol 25 unq 0 iso 1 dist 6.00307 11.2808 9.48085 3.8857 4.79873 12.7147 numMergedOcc 0
4 mol 34 unq 0 iso 0 dist 8.16494 4.71262 7.18022 4.28439 6.24711 3.39994 numMergedOcc 0
5 mol 34 unq 0 iso 1 dist 8.16494 4.28439 6.24711 4.71262 7.18022 3.39994 numMergedOcc 0
6 mol 78 unq 0 iso 0 dist 9.45835 7.18645 6.85523 12.613 5.77326 8.2592 numMergedOcc 0
7 mol 78 unq 0 iso 1 dist 9.45835 12.613 5.77326 7.18645 6.85523 8.2592 numMergedOcc 0
8 mol 95 unq 0 iso 0 dist 8.13273 3.84897 8.27883 5.78182 5.75428 6.27231 numMergedOcc 0
9 mol 95 unq 0 iso 1 dist 8.13273 5.78182 5.75428 3.84897 8.27883 6.27231 numMergedOcc 0
10 mol 95 unq 1 iso 0 dist 8.13273 3.84897 8.27883 12.5746 8.57395 11.734 numMergedOcc 0
11 mol 95 unq 1 iso 1 dist 8.13273 12.5746 8.57395 3.84897 8.27883 11.734 numMergedOcc 0
12 mol 95 unq 2 iso 0 dist 8.13273 3.84897 8.27883 16.9294 9.85409 17.4304 numMergedOcc 0
13 mol 95 unq 2 iso 1 dist 8.13273 16.9294 9.85409 3.84897 8.27883 17.4304 numMergedOcc 0
14 mol 95 unq 1 iso 0 dist 8.13273 5.78182 5.75428 12.5746 8.57395 6.95874 numMergedOcc 0
15 mol 95 unq 1 iso 1 dist 8.13273 12.5746 8.57395 5.78182 5.75428 6.95874 numMergedOcc 0
16 mol 95 unq 2 iso 0 dist 8.13273 5.78182 5.75428 16.9294 9.85409 12.3063 numMergedOcc 0
17 mol 95 unq 2 iso 1 dist 8.13273 16.9294 9.85409 5.78182 5.75428 12.3063 numMergedOcc 0
18 mol 95 unq 2 iso 0 dist 8.13273 12.5746 8.57395 16.9294 9.85409 9.43547 numMergedOcc 0
19 mol 95 unq 2 iso 1 dist 8.13273 16.9294 9.85409 12.5746 8.57395 9.43547 numMergedOcc 0
20 mol 134 unq 0 iso 0 dist 8.75736 14.0091 9.00918 15.5753 7.99477 4.87973 numMergedOcc 0
21 mol 134 unq 0 iso 1 dist 8.75736 15.5753 7.99477 14.0091 9.00918 4.87973 numMergedOcc 0
22 mol 134 unq 1 iso 0 dist 6.76166 9.88169 9.00918 11.8593 7.99477 4.87973 numMergedOcc 0
23 mol 134 unq 1 iso 1 dist 6.76166 11.8593 7.99477 9.88169 9.00918 4.87973 numMergedOcc 0
24 mol 186 unq 0 iso 0 dist 7.09426 12.6481 7.2793 13.7919 9.51091 3.47886 numMergedOcc 0
25 mol 186 unq 0 iso 1 dist 7.09426 13.7919 9.51091 12.6481 7.2793 3.47886 numMergedOcc 0
26 mol 186 unq 1 iso 0 dist 7.09426 12.6481 7.2793 3.97751 7.85184 12.5618 numMergedOcc 0
27 mol 186 unq 1 iso 1 dist 7.09426 3.97751 7.85184 12.6481 7.2793 12.5618 numMergedOcc 0
28 mol 186 unq 1 iso 0 dist 7.09426 13.7919 9.51091 3.97751 7.85184 14.2448 numMergedOcc 0
29 mol 186 unq 1 iso 1 dist 7.09426 3.97751 7.85184 13.7919 9.51091 14.2448 numMergedOcc 0
30 mol 192 unq 0 iso 0 dist 6.44896 4.77116 9.78634 4.65378 5.64942 5.9655 numMergedOcc 0
31 mol 192 unq 0 iso 1 dist 6.44896 4.65378 5.64942 4.77116 9.78634 5.9655 numMergedOcc 0
32 mol 192 unq 1 iso 0 dist 6.44896 4.77116 9.78634 5.48435 7.43054 7.70298 numMergedOcc 0
33 mol 192 unq 1 iso 1 dist 6.44896 5.48435 7.43054 4.77116 9.78634 7.70298 numMergedOcc 0
34 mol 192 unq 1 iso 0 dist 6.44896 4.65378 5.64942 5.48435 7.43054 3.60331 numMergedOcc 0
35 mol 192 unq 1 iso 1 dist 6.44896 5.48435 7.43054 4.65378 5.64942 3.60331 numMergedOcc 0
36 mol 235 unq 0 iso 0 dist 8.79626 9.92254 5.1823 5.66713 5.70635 4.8835 numMergedOcc 0
37 mol 235 unq 0 iso 1 dist 8.79626 5.66713 5.70635 9.92254 5.1823 4.8835 numMergedOcc 0
38 mol 243 unq 0 iso 0 dist 8.69557 4.02386 7.10671 8.36019 8.67156 6.67199 numMergedOcc 0
39 mol 243 unq 0 iso 1 dist 8.69557 8.36019 8.67156 4.02386 7.10671 6.67199 numMergedOcc 0
40 mol 243 unq 1 iso 0 dist 4.89168 6.41173 7.10671 5.7044 8.67156 6.67199 numMergedOcc 0
41 mol 243 unq 1 iso 1 dist 4.89168 5.7044 8.67156 6.41173 7.10671 6.67199 numMergedOcc 0
42 mol 259 unq 0 iso 0 dist 6.20344 10.4532 9.63573 5.13757 7.66153 10.3051 numMergedOcc 0
43 mol 259 unq 0 iso 1 dist 6.20344 5.13757 7.66153 10.4532 9.63573 10.3051 numMergedOcc 0
44 mol 270 unq 0 iso 0 dist 7.05331 3.8694 9.31275 5.76483 8.56508 5.42225 numMergedOcc 0
45 mol 270 unq 0 iso 1 dist 7.05331 5.76483 8.56508 3.8694 9.31275 5.42225 numMergedOcc 0
46 mol 277 unq 0 iso 0 dist 9.64889 5.36788 9.35539 15.23 8.9682 16.9644 numMergedOcc 0
47 mol 277 unq 0 iso 1 dist 9.64889 15.23 8.9682 5.36788 9.35539 16.9644 numMergedOcc 0
48 mol 277 unq 1 iso 0 dist 9.64889 5.36788 9.35539 15.0167 6.92711 15.8851 numMergedOcc 0
49 mol 277 unq 1 iso 1 dist 9.64889 15.0167 6.92711 5.36788 9.35539 15.8851 numMergedOcc 0
50 mol 277 unq 1 iso 0 dist 9.64889 15.23 8.9682 15.0167 6.92711 3.39114 numMergedOcc 0
51 mol 277 unq 1 iso 1 dist 9.64889 15.0167 6.92711 15.23 8.9682 3.39114 numMergedOcc 0
52 mol 292 unq 0 iso 0 dist 7.11081 5.04876 9.46442 5.37135 7.30758 3.57128 numMergedOcc 0
53 mol 292 unq 0 iso 1 dist 7.11081 5.37135 7.30758 5.04876 9.46442 3.57128 numMergedOcc 0
54 mol 292 unq 1 iso 0 dist 7.11081 5.04876 9.46442 7.24839 9.5785 11.3907 numMergedOcc 0
55 mol 292 unq 1 iso 1 dist 7.11081 7.24839 9.5785 5.04876 9.46442 11.3907 numMergedOcc 0
56 mol 292 unq 2 iso 0 dist 7.11081 5.04876 9.46442 8.58496 9.76319 13.609 numMergedOcc 0
57 mol 292 unq 2 iso 1 dist 7.11081 8.58496 9.76319 5.04876 9.46442 13.609 numMergedOcc 0
58 mol 292 unq 1 iso 0 dist 7.11081 5.37135 7.30758 7.24839 9.5785 10.0941 numMergedOcc 0
59 mol 292 unq 1 iso 1 dist 7.11081 7.24839 9.5785 5.37135 7.30758 10.0941 numMergedOcc 0
60 mol 292 unq 2 iso 0 dist 7.11081 5.37135 7.30758 8.58496 9.76319 13.2166 numMergedOcc 0
61 mol 292 unq 2 iso 1 dist 7.11081 8.58496 9.76319 5.37135 7.30758 13.2166 numMergedOcc 0
62 mol 292 unq 2 iso 0 dist 7.11081 7.24839 9.5785 8.58496 9.76319 7.00706 numMergedOcc 0
63 mol 292 unq 2 iso 1 dist 7.11081 8.58496 9.76319 7.24839 9.5785 7.00706 numMergedOcc 0
64 mol 292 unq 3 iso 0 dist 8.99442 6.17318 9.9182 4.77323 8.9221 9.43063 numMergedOcc 0
65 mol 292 unq 3 iso 1 dist 8.99442 4.77323 8.9221 6.17318 9.9182 9.43063 numMergedOcc 0
