0 mol 1 unq 0 iso 0 dist 9.44115 6.44928 8.56884 5.21705 5.96833 4.50502 12.6791 9.01967 9.00903 10.8992 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 7.90928 6.35409 8.56884 5.06184 5.96833 4.50502 12.2079 9.01967 9.00903 10.8992 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 8.77049 11.3797 6.33889 9.99243 9.81658 5.84314 12.8762 11.4878 8.57077 5.8245 numMergedOcc 0
3 mol 9 unq 1 iso 0 dist 6.95341 11.7623 6.33889 12.0088 9.81658 5.84314 13.0231 11.4878 8.57077 5.8245 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 8.62693 4.09495 9.16962 5.23054 5.84066 8.25132 10.8071 11.887 8.34347 13.6027 numMergedOcc 0
5 mol 26 unq 1 iso 0 dist 9.97117 5.3315 6.73162 12.2008 9.96121 7.11305 6.88695 7.23546 8.34347 14.8317 numMergedOcc 0
6 mol 115 unq 0 iso 0 dist 5.58063 5.24961 7.64585 8.29196 7.65255 6.95773 12.5192 10.2377 9.33865 6.24825 numMergedOcc 0
7 mol 115 unq 1 iso 0 dist 5.58063 5.24961 7.64585 8.29196 7.65255 6.95773 10.8398 10.8939 6.11741 10.0255 numMergedOcc 0
8 mol 117 unq 0 iso 0 dist 9.58171 10.4485 6.62561 5.61881 9.94053 7.20875 18.7881 11.3679 9.84395 16.804 numMergedOcc 0
9 mol 117 unq 1 iso 0 dist 9.58171 10.4485 6.62561 5.61881 9.94053 7.20875 6.90827 4.91401 7.90328 8.84018 numMergedOcc 0
10 mol 117 unq 2 iso 0 dist 9.58171 5.27151 7.63616 5.61881 9.94053 3.77029 6.90827 4.91401 7.83136 8.84018 numMergedOcc 0
11 mol 119 unq 0 iso 0 dist 8.95838 5.85391 9.63176 5.99531 6.55202 6.9194 13.3689 10.6679 8.73993 12.31 numMergedOcc 0
12 mol 119 unq 1 iso 0 dist 8.95838 5.85391 9.63176 11.2265 9.08536 9.68677 13.3689 10.6679 8.73993 7.64052 numMergedOcc 0
13 mol 119 unq 2 iso 0 dist 8.95838 11.0075 7.44174 5.99531 6.55202 12.4621 13.2232 7.36192 9.87172 11.2897 numMergedOcc 0
14 mol 119 unq 3 iso 0 dist 8.95838 11.0075 7.44174 11.2265 9.08536 6.20019 13.2232 7.36192 9.87172 6.99446 numMergedOcc 0
15 mol 119 unq 4 iso 0 dist 9.47892 18.2257 9.63176 13.9667 6.55202 6.9194 19.5006 10.6679 8.73993 12.31 numMergedOcc 0
16 mol 119 unq 5 iso 0 dist 9.47892 18.2257 9.63176 15.453 9.08536 9.68677 19.5006 10.6679 8.73993 7.64052 numMergedOcc 0
17 mol 119 unq 6 iso 0 dist 9.47892 9.93013 7.44174 13.9667 6.55202 12.4621 15.3808 7.36192 9.87172 11.2897 numMergedOcc 0
18 mol 119 unq 7 iso 0 dist 9.47892 9.93013 7.44174 15.453 9.08536 6.20019 15.3808 7.36192 9.87172 6.99446 numMergedOcc 0
19 mol 155 unq 0 iso 0 dist 7.50392 4.94973 9.38946 5.68679 7.29911 4.91785 11.1867 12.8482 6.43582 8.97626 numMergedOcc 0
20 mol 155 unq 1 iso 0 dist 8.02593 9.80448 7.36102 5.05961 5.36254 4.91785 12.6683 8.27726 6.43582 8.97626 numMergedOcc 0
21 mol 155 unq 2 iso 0 dist 8.77391 4.94973 7.36102 5.68679 5.36254 4.91785 11.1867 8.27726 6.43582 8.97626 numMergedOcc 0
22 mol 181 unq 0 iso 0 dist 6.17129 4.3158 4.93785 7.19461 9.09234 6.8757 9.84952 6.7991 7.81386 6.64173 numMergedOcc 0
23 mol 181 unq 1 iso 0 dist 6.17129 4.3158 4.93785 9.77747 6.76746 5.71898 9.84952 6.7991 7.81386 9.01624 numMergedOcc 0
24 mol 181 unq 2 iso 0 dist 6.17129 4.3158 4.93785 10.0615 8.92098 5.83796 9.84952 6.7991 7.81386 9.55105 numMergedOcc 0
25 mol 181 unq 3 iso 0 dist 5.83596 4.3226 4.93785 11.195 9.09234 6.8757 10.8641 6.7991 7.81386 6.64173 numMergedOcc 0
26 mol 181 unq 4 iso 0 dist 5.83596 4.3226 4.93785 4.76079 6.76746 5.71898 10.8641 6.7991 7.81386 9.01624 numMergedOcc 0
27 mol 181 unq 5 iso 0 dist 5.83596 4.3226 4.93785 6.38851 8.92098 5.83796 10.8641 6.7991 7.81386 9.55105 numMergedOcc 0
28 mol 197 unq 0 iso 0 dist 8.32685 10.5326 8.99696 15.7632 9.27218 17.0276 15.4893 9.82139 8.56633 12.8171 numMergedOcc 0
29 mol 197 unq 1 iso 0 dist 6.74777 5.29309 8.99696 15.6628 9.27218 17.0276 11.6279 9.82139 8.56633 12.8171 numMergedOcc 0
30 mol 197 unq 2 iso 0 dist 9.62514 4.57437 8.99696 18.7224 9.27218 17.0276 12.5442 9.82139 8.56633 12.8171 numMergedOcc 0
31 mol 227 unq 0 iso 0 dist 8.42382 7.2593 9.62609 12.9828 9.8009 14.6485 15 14.6185 8.65997 15.9467 numMergedOcc 0
32 mol 238 unq 0 iso 0 dist 9.94175 13.8985 5.38637 10.2069 9.38131 13.378 10.6346 6.20606 6.57393 14.7404 numMergedOcc 0
33 mol 238 unq 1 iso 0 dist 9.94175 14.9782 6.55759 10.2069 9.38131 10.4966 13.9196 10.4664 7.31233 9.7696 numMergedOcc 0
34 mol 238 unq 2 iso 0 dist 8.81534 5.33567 5.38637 16.1646 9.38131 13.378 6.24928 6.20606 6.57393 14.7404 numMergedOcc 0
35 mol 238 unq 3 iso 0 dist 8.81534 9.85437 6.55759 16.1646 9.38131 10.4966 11.3074 10.4664 7.31233 9.7696 numMergedOcc 0
36 mol 238 unq 4 iso 0 dist 9.46582 9.23693 7.67322 5.17342 7.39547 5.71717 14.9617 12.6986 7.31233 10.1172 numMergedOcc 0
37 mol 259 unq 0 iso 0 dist 9.53092 4.77548 7.48005 9.92544 8.84648 10.282 12.348 11.6195 7.88519 14.2242 numMergedOcc 0
38 mol 259 unq 1 iso 0 dist 9.53092 4.77548 7.48005 9.92544 8.84648 10.282 12.2873 11.8736 7.84554 16.7322 numMergedOcc 0
39 mol 259 unq 2 iso 0 dist 9.53092 4.77548 7.48005 9.92544 8.84648 10.282 11.6963 5.79468 7.46176 11.7465 numMergedOcc 0
40 mol 259 unq 3 iso 0 dist 9.53092 4.77548 7.48005 9.92544 8.84648 10.282 12.3184 12.6649 9.18903 19.0182 numMergedOcc 0
41 mol 259 unq 4 iso 0 dist 9.53092 4.77548 7.48005 12.9171 6.23661 10.067 12.348 11.6195 7.88519 10.3406 numMergedOcc 0
42 mol 259 unq 5 iso 0 dist 9.53092 4.77548 7.48005 12.9171 6.23661 10.067 12.2873 11.8736 7.84554 12.8546 numMergedOcc 0
43 mol 259 unq 6 iso 0 dist 9.53092 4.77548 7.48005 12.9171 6.23661 10.067 11.6963 5.79468 7.46176 5.85442 numMergedOcc 0
44 mol 259 unq 7 iso 0 dist 9.53092 4.77548 7.48005 12.9171 6.23661 10.067 12.3184 12.6649 9.18903 16.0301 numMergedOcc 0
45 mol 259 unq 8 iso 0 dist 9.53092 12.7699 8.37865 9.92544 8.84648 4.04513 12.9189 5.31048 5.30224 8.03219 numMergedOcc 0
46 mol 259 unq 9 iso 0 dist 9.53092 12.7699 8.37865 12.9171 6.23661 7.09907 12.9189 5.31048 5.30224 6.9899 numMergedOcc 0
47 mol 282 unq 0 iso 0 dist 9.20119 12.5533 6.85028 10.9015 7.52924 4.57104 15.5242 6.3384 8.04483 10.2229 numMergedOcc 0
48 mol 282 unq 1 iso 0 dist 9.20119 14.3567 7.32347 10.9015 7.52924 5.29852 15.5242 6.3384 6.33524 10.2229 numMergedOcc 0
49 mol 282 unq 2 iso 0 dist 8.96997 4.64783 6.85028 7.77671 7.52924 4.57104 11.3408 6.3384 8.04483 10.2229 numMergedOcc 0
50 mol 282 unq 3 iso 0 dist 8.96997 10.0286 7.32347 7.77671 7.52924 5.29852 11.3408 6.3384 6.33524 10.2229 numMergedOcc 0
