0 mol 7 unq 0 iso 0 dist 9.8603 15.8072 8.72114 15.262 11.8172 6.02702 17.7278 11.0773 8.43473 9.60499 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.81271 4.60206 9.68006 5.51421 5.13353 5.99972 10.6104 11.659 12.0193 8.41585 numMergedOcc 0
2 mol 8 unq 0 iso 0 dist 7.46102 10.4489 8.53529 9.91301 8.4069 7.18019 8.25051 8.96553 4.36226 9.62879 numMergedOcc 0
3 mol 8 unq 1 iso 0 dist 9.91301 10.4489 7.18019 7.46102 8.4069 8.53529 8.25051 9.62879 4.36226 8.96553 numMergedOcc 0
4 mol 16 unq 0 iso 0 dist 6.36377 5.96976 6.93532 12.1997 10.4852 6.72833 12.4209 11.6856 6.51133 4.7319 numMergedOcc 0
5 mol 24 unq 0 iso 0 dist 9.54519 12.1061 8.4051 18.501 15.5315 7.29868 18.4381 15.5324 8.52463 6.86014 numMergedOcc 0
6 mol 24 unq 1 iso 0 dist 9.54519 12.1061 8.4051 12.511 14.6259 8.60554 18.4381 15.5324 8.52463 8.86116 numMergedOcc 0
7 mol 24 unq 2 iso 0 dist 9.54519 12.1061 8.4051 12.511 14.6259 8.60554 18.332 17.8264 12.3994 8.38394 numMergedOcc 0
8 mol 24 unq 3 iso 0 dist 9.54519 6.81998 8.75662 12.511 14.6259 9.44691 18.4381 15.5324 13.4893 8.86116 numMergedOcc 0
9 mol 24 unq 4 iso 0 dist 9.54519 6.81998 8.75662 12.511 14.6259 9.44691 18.332 17.8264 12.505 8.38394 numMergedOcc 0
10 mol 24 unq 5 iso 0 dist 6.11056 11.095 8.60554 14.2881 14.6259 8.4051 14.0772 13.2433 5.11617 5.54419 numMergedOcc 0
11 mol 24 unq 6 iso 0 dist 6.11056 11.095 8.60554 14.2881 14.6259 8.4051 13.3975 15.5296 13.2229 7.36323 numMergedOcc 0
12 mol 24 unq 7 iso 0 dist 6.11056 11.095 8.60554 14.4535 10.0952 7.29868 10.4744 8.86116 8.52463 6.86014 numMergedOcc 0
13 mol 24 unq 8 iso 0 dist 6.11056 6.66757 9.44691 14.2881 14.6259 8.75662 14.0772 13.2433 10.8238 5.54419 numMergedOcc 0
14 mol 24 unq 9 iso 0 dist 6.11056 6.66757 9.44691 14.2881 14.6259 8.75662 13.3975 15.5296 6.7828 7.36323 numMergedOcc 0
15 mol 25 unq 0 iso 0 dist 8.40051 4.32173 6.16347 8.6396 10.9391 7.45383 5.8503 11.9561 7.33728 5.04899 numMergedOcc 0
16 mol 25 unq 1 iso 0 dist 8.40051 15.9662 7.92503 17.3995 10.6808 8.6653 20.0112 12.4135 5.64303 7.31767 numMergedOcc 0
17 mol 25 unq 2 iso 0 dist 8.40051 15.9662 7.92503 17.3995 10.6808 8.6653 19.8215 11.6743 5.82503 6.03987 numMergedOcc 0
18 mol 25 unq 3 iso 0 dist 8.6396 4.32173 7.45383 8.40051 10.9391 6.16347 13.466 12.7009 9.34396 7.57578 numMergedOcc 0
19 mol 25 unq 4 iso 0 dist 8.6396 4.32173 7.45383 8.40051 10.9391 6.16347 14.4191 12.8117 10.8498 7.17969 numMergedOcc 0
20 mol 25 unq 5 iso 0 dist 8.88413 10.7087 7.55264 16.9711 16.1048 8.87757 16.046 12.8117 5.77929 5.04899 numMergedOcc 0
21 mol 25 unq 6 iso 0 dist 8.88413 10.7087 7.55264 10.5993 4.33106 8.50222 5.59268 7.17969 6.08585 7.57578 numMergedOcc 0
22 mol 58 unq 0 iso 0 dist 6.36193 4.37642 5.93884 9.01612 5.30792 9.92355 5.40367 6.62496 5.78774 6.86465 numMergedOcc 0
23 mol 58 unq 1 iso 0 dist 6.36193 4.37642 5.93884 4.88613 4.81926 7.68678 5.40367 6.62496 5.78774 6.35756 numMergedOcc 0
24 mol 58 unq 2 iso 0 dist 4.88613 4.37642 7.68678 9.01612 5.35073 9.92355 5.40367 6.35756 5.78774 6.86465 numMergedOcc 0
25 mol 58 unq 3 iso 0 dist 4.88613 4.37642 7.68678 6.36193 4.81926 5.93884 5.40367 6.35756 5.78774 6.62496 numMergedOcc 0
26 mol 85 unq 0 iso 0 dist 6.58793 3.88757 7.54568 11.7434 10.1164 9.39864 7.83419 7.66905 4.65335 5.73196 numMergedOcc 0
27 mol 119 unq 0 iso 0 dist 8.44385 4.01593 9.11344 5.63005 4.85907 6.52773 10.5268 10.3704 7.20179 8.73993 numMergedOcc 0
28 mol 119 unq 1 iso 0 dist 5.63005 4.01593 6.52773 8.44385 4.85907 9.11344 12.1192 12.6489 10.9441 9.87172 numMergedOcc 0
29 mol 133 unq 0 iso 0 dist 9.3894 11.5759 6.66772 10.2159 6.69554 9.97654 13.0836 9.52634 4.34568 9.91388 numMergedOcc 0
30 mol 133 unq 1 iso 0 dist 9.3894 11.5759 6.66772 14.8299 7.6656 7.71248 13.0836 9.52634 4.34568 7.24514 numMergedOcc 0
31 mol 133 unq 2 iso 0 dist 9.3894 11.5759 6.66772 14.8299 7.6656 7.71248 16.1037 13.4163 10.6025 8.22656 numMergedOcc 0
32 mol 181 unq 0 iso 0 dist 9.58911 12.0718 6.22122 9.86845 6.01247 6.2479 9.47799 9.94371 6.6251 9.1374 numMergedOcc 0
33 mol 181 unq 1 iso 0 dist 9.58911 12.0718 6.22122 9.86845 6.01247 6.2479 17.6006 10.9639 7.81713 8.03334 numMergedOcc 0
34 mol 181 unq 2 iso 0 dist 9.58911 12.0718 6.22122 13.0329 12.6324 7.99195 9.47799 9.94371 6.6251 5.98885 numMergedOcc 0
35 mol 181 unq 3 iso 0 dist 9.58911 12.0718 6.22122 13.0329 12.6324 7.99195 19.5061 16.2058 10.09 9.09537 numMergedOcc 0
36 mol 206 unq 0 iso 0 dist 9.36079 10.9922 6.16414 14.4684 5.63422 7.75885 20.4169 11.1804 12.7604 8.02137 numMergedOcc 0
37 mol 206 unq 1 iso 0 dist 9.36079 10.9922 6.16414 14.4684 5.63422 7.75885 13.6173 7.7366 6.45859 9.774 numMergedOcc 0
38 mol 206 unq 2 iso 0 dist 7.42904 8.16827 6.16414 12.7047 5.63422 7.75885 17.7981 11.1804 12.7604 8.02137 numMergedOcc 0
39 mol 206 unq 3 iso 0 dist 7.42904 8.16827 6.16414 12.7047 5.63422 7.75885 9.96254 7.7366 6.45859 9.774 numMergedOcc 0
40 mol 227 unq 0 iso 0 dist 9.07872 4.21811 6.02296 11.3366 4.39704 7.43071 8.65229 10.4905 6.00424 9.34734 numMergedOcc 0
41 mol 227 unq 1 iso 0 dist 9.07872 4.21811 6.02296 11.3366 4.39704 7.43071 9.9474 7.09863 6.35849 7.22101 numMergedOcc 0
42 mol 227 unq 2 iso 0 dist 9.07872 4.21811 6.02296 11.3366 4.39704 7.43071 14.0536 10.8157 10.204 8.65997 numMergedOcc 0
43 mol 227 unq 3 iso 0 dist 9.07872 4.21811 6.02296 11.3366 4.39704 7.43071 13.0161 11.0431 9.76735 7.56888 numMergedOcc 0
44 mol 227 unq 4 iso 0 dist 9.07872 4.21811 6.02296 11.3366 4.39704 7.43071 11.8065 10.0334 9.32448 7.55216 numMergedOcc 0
45 mol 231 unq 0 iso 0 dist 8.01942 3.83595 6.54852 9.97221 4.06055 6.98875 8.55683 8.40182 6.37275 7.37839 numMergedOcc 0
46 mol 232 unq 0 iso 0 dist 7.70279 6.36084 8.50102 9.29752 6.56633 9.40808 9.60401 10.5803 4.9377 8.27212 numMergedOcc 0
47 mol 258 unq 0 iso 0 dist 9.59174 5.32742 9.63959 9.98141 12.321 7.21311 4.16729 10.5548 5.63675 6.60405 numMergedOcc 0
48 mol 259 unq 0 iso 0 dist 8.06771 5.61261 7.98231 11.1503 6.96053 7.08526 9.79538 7.88519 8.81835 7.46176 numMergedOcc 0
49 mol 259 unq 1 iso 0 dist 9.54857 8.74892 7.08526 14.0139 6.96053 7.98231 16.7125 10.3935 8.41846 8.13497 numMergedOcc 0
50 mol 259 unq 2 iso 0 dist 9.54857 8.74892 7.08526 14.0139 6.96053 7.98231 15.3806 7.46176 8.81835 7.88519 numMergedOcc 0
51 mol 274 unq 0 iso 0 dist 6.55855 5.15747 6.39866 12.6706 11.3308 8.52587 9.85454 11.3168 5.29529 7.56915 numMergedOcc 0
