0 mol 7 unq 0 iso 0 dist 5.72491 9.67164 8.0744 7.12508 8.15894 12.8006 12.2041 7.88043 5.99459 12.8323 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.88043 5.99459 8.0744 12.8323 8.15894 12.8006 12.2041 5.72491 9.67164 7.12508 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 8.80762 5.99459 11.7002 12.8323 8.45544 12.8006 12.2041 9.67579 9.67164 7.12508 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 9.93832 6.6263 4.55347 10.8828 7.24352 8.34145 8.13395 8.60739 6.75943 5.07458 numMergedOcc 0
4 mol 43 unq 1 iso 0 dist 8.60739 6.75943 4.55347 5.07458 7.24352 8.34145 8.13395 9.93832 6.6263 10.8828 numMergedOcc 0
5 mol 115 unq 0 iso 0 dist 5.72642 9.42082 10.5109 5.03039 8.4965 14.3113 7.69052 10.9734 6.39384 11.1447 numMergedOcc 0
6 mol 134 unq 0 iso 0 dist 7.36779 9.66543 4.935 14.2036 8.48313 12.2382 5.62899 8.20836 7.21868 16.4114 numMergedOcc 0
7 mol 134 unq 1 iso 0 dist 7.36779 9.66543 4.935 14.2036 8.48313 12.2382 10.7144 10.873 7.93372 18.3331 numMergedOcc 0
8 mol 134 unq 2 iso 0 dist 7.36779 9.66543 4.935 10.092 6.99345 11.2397 5.62899 8.20836 7.21868 12.8086 numMergedOcc 0
9 mol 134 unq 3 iso 0 dist 7.36779 9.66543 4.935 10.092 6.99345 11.2397 10.7144 10.873 7.93372 15.0225 numMergedOcc 0
10 mol 134 unq 4 iso 0 dist 7.36779 9.66543 4.935 4.46337 5.11043 8.62504 5.62899 8.20836 7.21868 7.41373 numMergedOcc 0
11 mol 134 unq 5 iso 0 dist 7.36779 9.66543 4.935 4.46337 5.11043 8.62504 10.7144 10.873 7.93372 10.8635 numMergedOcc 0
12 mol 134 unq 6 iso 0 dist 8.20836 7.21868 4.935 16.4114 8.48313 12.2382 5.62899 7.36779 9.66543 14.2036 numMergedOcc 0
13 mol 134 unq 7 iso 0 dist 8.20836 7.21868 4.935 16.4114 8.48313 12.2382 5.49782 10.873 7.93372 18.3331 numMergedOcc 0
14 mol 134 unq 8 iso 0 dist 8.20836 7.21868 4.935 12.8086 6.99345 11.2397 5.62899 7.36779 9.66543 10.092 numMergedOcc 0
15 mol 134 unq 9 iso 0 dist 8.20836 7.21868 4.935 12.8086 6.99345 11.2397 5.49782 10.873 7.93372 15.0225 numMergedOcc 0
16 mol 134 unq 10 iso 0 dist 8.20836 7.21868 4.935 7.41373 5.11043 8.62504 5.62899 7.36779 9.66543 4.46337 numMergedOcc 0
17 mol 134 unq 11 iso 0 dist 8.20836 7.21868 4.935 7.41373 5.11043 8.62504 5.49782 10.873 7.93372 10.8635 numMergedOcc 0
18 mol 152 unq 0 iso 0 dist 9.77552 6.59889 4.71678 12.4535 6.92726 10.4667 7.65448 8.28642 6.70693 9.84297 numMergedOcc 0
19 mol 152 unq 1 iso 0 dist 8.28642 6.70693 4.71678 9.84297 6.92726 10.4667 7.65448 9.77552 6.59889 12.4535 numMergedOcc 0
20 mol 207 unq 0 iso 0 dist 7.96797 6.0563 7.64813 4.56899 8.78061 9.29133 5.99308 13.9435 9.98372 8.23012 numMergedOcc 0
21 mol 207 unq 1 iso 0 dist 7.96797 8.1244 11.9725 4.56899 8.78061 12.1046 5.99308 13.9435 9.1528 8.23012 numMergedOcc 0
22 mol 218 unq 0 iso 0 dist 8.86175 8.75536 13.4147 3.8877 8.04838 10.6793 4.72474 6.29511 7.33709 6.0516 numMergedOcc 0
23 mol 218 unq 1 iso 0 dist 8.86175 8.75536 13.4147 3.8877 8.04838 10.6793 6.17651 9.91544 6.67404 5.38451 numMergedOcc 0
24 mol 218 unq 2 iso 0 dist 6.29511 7.33709 13.4147 6.0516 8.04838 10.6793 4.72474 8.86175 8.75536 3.8877 numMergedOcc 0
25 mol 218 unq 3 iso 0 dist 6.29511 7.33709 13.4147 6.0516 8.04838 10.6793 5.61978 9.91544 6.67404 5.38451 numMergedOcc 0
26 mol 227 unq 0 iso 0 dist 8.38865 5.23634 7.3164 4.1511 5.28771 6.09335 5.22356 5.4694 6.91318 4.69247 numMergedOcc 0
27 mol 227 unq 1 iso 0 dist 5.4694 6.91318 7.3164 4.69247 5.28771 6.09335 5.22356 8.38865 5.23634 4.1511 numMergedOcc 0
28 mol 229 unq 0 iso 0 dist 8.92743 7.27993 6.93188 11.0437 6.42694 12.4584 5.1556 11.2687 9.51168 12.0139 numMergedOcc 0
29 mol 229 unq 1 iso 0 dist 8.92743 7.27993 6.93188 11.0437 6.42694 12.4584 7.0298 5.77318 6.95201 7.46815 numMergedOcc 0
30 mol 229 unq 2 iso 0 dist 8.92743 7.27993 6.93188 11.9989 7.63917 11.5308 5.1556 11.2687 9.51168 10.8857 numMergedOcc 0
31 mol 229 unq 3 iso 0 dist 8.92743 7.27993 6.93188 11.9989 7.63917 11.5308 7.0298 5.77318 6.95201 5.37687 numMergedOcc 0
32 mol 229 unq 4 iso 0 dist 5.77318 6.95201 6.93188 7.46815 6.42694 12.4584 7.0298 8.92743 7.27993 11.0437 numMergedOcc 0
33 mol 229 unq 5 iso 0 dist 5.77318 6.95201 6.93188 7.46815 6.42694 12.4584 6.54885 11.2687 9.51168 12.0139 numMergedOcc 0
34 mol 229 unq 6 iso 0 dist 5.77318 6.95201 6.93188 5.37687 7.63917 11.5308 7.0298 8.92743 7.27993 11.9989 numMergedOcc 0
35 mol 229 unq 7 iso 0 dist 5.77318 6.95201 6.93188 5.37687 7.63917 11.5308 6.54885 11.2687 9.51168 10.8857 numMergedOcc 0
36 mol 238 unq 0 iso 0 dist 5.52379 6.99888 5.63944 4.48415 6.53286 9.51483 10.1813 11.9624 9.08509 10.3162 numMergedOcc 0
37 mol 264 unq 0 iso 0 dist 7.52281 5.90924 7.36132 5.71153 6.02757 9.78237 7.07277 12.2392 5.90058 12.6872 numMergedOcc 0
38 mol 264 unq 1 iso 0 dist 7.52281 5.90924 7.36132 5.71153 6.02757 9.78237 8.96144 6.42588 9.58916 6.56539 numMergedOcc 0
39 mol 264 unq 2 iso 0 dist 7.52281 5.90924 7.36132 6.87635 8.67231 9.95798 7.07277 12.2392 5.90058 12.9337 numMergedOcc 0
40 mol 264 unq 3 iso 0 dist 7.52281 5.90924 7.36132 6.87635 8.67231 9.95798 8.96144 6.42588 9.58916 4.76241 numMergedOcc 0
41 mol 264 unq 4 iso 0 dist 6.42588 9.58916 7.36132 6.56539 6.02757 9.78237 8.96144 7.52281 5.90924 5.71153 numMergedOcc 0
42 mol 264 unq 5 iso 0 dist 6.42588 9.58916 7.36132 6.56539 6.02757 9.78237 14.3597 12.2392 5.90058 12.6872 numMergedOcc 0
43 mol 264 unq 6 iso 0 dist 6.42588 9.58916 7.36132 4.76241 8.67231 9.95798 8.96144 7.52281 5.90924 6.87635 numMergedOcc 0
44 mol 264 unq 7 iso 0 dist 6.42588 9.58916 7.36132 4.76241 8.67231 9.95798 14.3597 12.2392 5.90058 12.9337 numMergedOcc 0
45 mol 264 unq 8 iso 0 dist 6.04162 9.19754 5.82131 11.4167 7.14086 9.78237 4.92077 6.14323 8.29262 13.2035 numMergedOcc 0
46 mol 264 unq 9 iso 0 dist 6.14323 8.29262 5.82131 13.2035 7.14086 9.78237 4.92077 6.04162 9.19754 11.4167 numMergedOcc 0
