0 mol 43 unq 0 iso 0 dist 8.21247 5.39546 6.6263 12.2906 6.75943 8.13395 15.2071 8.34145 10.8828 5.07458 numMergedOcc 0
1 mol 43 unq 0 iso 1 dist 8.21247 12.2906 6.75943 5.39546 6.6263 8.13395 15.2071 8.34145 5.07458 10.8828 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 9.73179 4.80624 6.72869 14.1154 9.85905 10.2879 5.34337 9.59729 5.31985 15.4159 numMergedOcc 0
3 mol 76 unq 0 iso 1 dist 9.73179 14.1154 9.85905 4.80624 6.72869 10.2879 5.34337 9.59729 15.4159 5.31985 numMergedOcc 0
4 mol 112 unq 0 iso 0 dist 6.6536 10.8268 7.7988 11.179 9.40824 4.97527 8.8974 6.96745 11.0625 14.5726 numMergedOcc 0
5 mol 112 unq 0 iso 1 dist 6.6536 11.179 9.40824 10.8268 7.7988 4.97527 8.8974 6.96745 14.5726 11.0625 numMergedOcc 0
6 mol 112 unq 1 iso 0 dist 6.6536 10.8268 7.7988 4.87668 4.22363 6.34999 8.8974 6.96745 11.0625 9.05551 numMergedOcc 0
7 mol 112 unq 1 iso 1 dist 6.6536 4.87668 4.22363 10.8268 7.7988 6.34999 8.8974 6.96745 9.05551 11.0625 numMergedOcc 0
8 mol 112 unq 1 iso 0 dist 6.6536 11.179 9.40824 4.87668 4.22363 6.72751 8.8974 6.96745 14.5726 9.05551 numMergedOcc 0
9 mol 112 unq 1 iso 1 dist 6.6536 4.87668 4.22363 11.179 9.40824 6.72751 8.8974 6.96745 9.05551 14.5726 numMergedOcc 0
10 mol 134 unq 0 iso 0 dist 4.73115 5.57177 5.35237 10.8108 7.99477 6.90348 6.98491 5.78982 5.4761 5.03507 numMergedOcc 0
11 mol 134 unq 0 iso 1 dist 4.73115 10.8108 7.99477 5.57177 5.35237 6.90348 6.98491 5.78982 5.03507 5.4761 numMergedOcc 0
12 mol 170 unq 0 iso 0 dist 9.66676 11.4871 9.08274 6.45787 9.51256 8.56034 5.03109 8.75024 6.86812 5.7304 numMergedOcc 0
13 mol 170 unq 0 iso 1 dist 9.66676 6.45787 9.51256 11.4871 9.08274 8.56034 5.03109 8.75024 5.7304 6.86812 numMergedOcc 0
14 mol 181 unq 0 iso 0 dist 5.97971 10.8374 9.01624 4.62576 5.05973 11.5866 8.70425 9.92831 5.42158 10.0773 numMergedOcc 0
15 mol 181 unq 0 iso 1 dist 5.97971 4.62576 5.05973 10.8374 9.01624 11.5866 8.70425 9.92831 10.0773 5.42158 numMergedOcc 0
16 mol 181 unq 1 iso 0 dist 8.72747 11.9541 9.01624 4.80932 5.05973 11.5866 8.28396 9.92831 5.42158 10.0773 numMergedOcc 0
17 mol 181 unq 1 iso 1 dist 8.72747 4.80932 5.05973 11.9541 9.01624 11.5866 8.28396 9.92831 10.0773 5.42158 numMergedOcc 0
18 mol 181 unq 2 iso 0 dist 8.23845 8.672 9.01624 6.42223 5.05973 11.5866 4.60202 9.92831 5.42158 10.0773 numMergedOcc 0
19 mol 181 unq 2 iso 1 dist 8.23845 6.42223 5.05973 8.672 9.01624 11.5866 4.60202 9.92831 10.0773 5.42158 numMergedOcc 0
20 mol 197 unq 0 iso 0 dist 7.86042 7.17757 9.10817 5.75906 6.86828 5.43601 3.35829 6.69042 9.61454 7.59871 numMergedOcc 0
21 mol 197 unq 0 iso 1 dist 7.86042 5.75906 6.86828 7.17757 9.10817 5.43601 3.35829 6.69042 7.59871 9.61454 numMergedOcc 0
22 mol 205 unq 0 iso 0 dist 8.92597 7.22201 7.21137 12.3312 8.4844 10.817 10.023 5.03818 4.3093 8.90569 numMergedOcc 0
23 mol 205 unq 0 iso 1 dist 8.92597 12.3312 8.4844 7.22201 7.21137 10.817 10.023 5.03818 8.90569 4.3093 numMergedOcc 0
24 mol 205 unq 1 iso 0 dist 8.92597 7.22201 7.21137 12.3312 8.4844 10.817 6.22981 6.40171 7.94891 6.37317 numMergedOcc 0
25 mol 205 unq 1 iso 1 dist 8.92597 12.3312 8.4844 7.22201 7.21137 10.817 6.22981 6.40171 6.37317 7.94891 numMergedOcc 0
26 mol 205 unq 2 iso 0 dist 7.53734 13.6728 7.21137 7.78052 8.4844 10.817 10.1222 5.03818 4.3093 8.90569 numMergedOcc 0
27 mol 205 unq 2 iso 1 dist 7.53734 7.78052 8.4844 13.6728 7.21137 10.817 10.1222 5.03818 8.90569 4.3093 numMergedOcc 0
28 mol 205 unq 3 iso 0 dist 7.53734 13.6728 7.21137 7.78052 8.4844 10.817 10.4922 6.40171 7.94891 6.37317 numMergedOcc 0
29 mol 205 unq 3 iso 1 dist 7.53734 7.78052 8.4844 13.6728 7.21137 10.817 10.4922 6.40171 6.37317 7.94891 numMergedOcc 0
30 mol 205 unq 4 iso 0 dist 9.79826 14.1866 7.21137 13.0749 8.4844 10.817 9.99561 5.03818 4.3093 8.90569 numMergedOcc 0
31 mol 205 unq 4 iso 1 dist 9.79826 13.0749 8.4844 14.1866 7.21137 10.817 9.99561 5.03818 8.90569 4.3093 numMergedOcc 0
32 mol 205 unq 5 iso 0 dist 9.79826 14.1866 7.21137 13.0749 8.4844 10.817 15.2328 6.40171 7.94891 6.37317 numMergedOcc 0
33 mol 205 unq 5 iso 1 dist 9.79826 13.0749 8.4844 14.1866 7.21137 10.817 15.2328 6.40171 6.37317 7.94891 numMergedOcc 0
34 mol 238 unq 0 iso 0 dist 5.52788 10.313 9.12776 7.04671 9.72188 15.7907 4.70535 4.66186 5.71717 10.4706 numMergedOcc 0
35 mol 238 unq 0 iso 1 dist 5.52788 7.04671 9.72188 10.313 9.12776 15.7907 4.70535 4.66186 10.4706 5.71717 numMergedOcc 0
36 mol 251 unq 0 iso 0 dist 9.65275 10.1306 9.82601 10.2078 6.50357 5.19086 4.66259 9.02417 13.28 11.5298 numMergedOcc 0
37 mol 251 unq 0 iso 1 dist 9.65275 10.2078 6.50357 10.1306 9.82601 5.19086 4.66259 9.02417 11.5298 13.28 numMergedOcc 0
