0 mol 7 unq 0 iso 0 dist 8.41585 7.88043 10.2446 5.99972 12.0193 7.25346 5.13353 11.659 12.8015 9.68006 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.41585 8.80762 12.3097 5.99972 12.0193 10.0658 5.13353 11.659 12.5387 9.68006 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 7.10621 5.72491 5.44992 8.72114 13.8829 10.1959 11.8172 18.3807 14.9635 6.02702 numMergedOcc 0
3 mol 8 unq 0 iso 0 dist 8.96553 7.3915 7.43529 8.53529 4.36226 5.65816 12.4076 10.9634 6.82379 7.03958 numMergedOcc 0
4 mol 8 unq 1 iso 0 dist 8.96553 7.3915 7.43529 8.53529 4.36226 5.65816 8.4069 9.62879 10.6335 7.18019 numMergedOcc 0
5 mol 8 unq 2 iso 0 dist 8.96553 7.3915 7.43529 8.53529 4.36226 5.65816 12.9016 12.4058 11.7258 8.44009 numMergedOcc 0
6 mol 19 unq 0 iso 0 dist 7.20519 6.92532 12.3486 7.75618 4.96411 13.9675 7.67038 10.4091 10.1882 8.40416 numMergedOcc 0
7 mol 19 unq 1 iso 0 dist 4.54938 6.92532 5.18512 7.75618 9.74255 13.9675 7.67038 8.4674 10.1882 8.40416 numMergedOcc 0
8 mol 19 unq 2 iso 0 dist 6.864 6.92532 9.47529 7.75618 7.08342 13.9675 7.67038 4.51865 10.1882 8.40416 numMergedOcc 0
9 mol 24 unq 0 iso 0 dist 6.86014 6.60423 6.00575 9.41441 6.66749 11.9395 11.4989 11.0194 14.156 6.73939 numMergedOcc 0
10 mol 24 unq 1 iso 0 dist 8.86116 6.72502 6.58998 8.60554 8.52463 6.99746 14.6259 15.5324 11.2485 8.4051 numMergedOcc 0
11 mol 24 unq 2 iso 0 dist 8.86116 6.72502 6.58998 8.60554 8.52463 6.99746 10.0952 6.86014 10.7114 7.29868 numMergedOcc 0
12 mol 24 unq 3 iso 0 dist 8.86116 6.72502 6.58998 9.44691 13.4893 7.05541 14.6259 15.5324 11.2485 8.75662 numMergedOcc 0
13 mol 24 unq 4 iso 0 dist 8.86116 6.60423 5.97304 9.41441 14.012 11.9395 11.4989 13.2433 14.156 6.73939 numMergedOcc 0
14 mol 24 unq 5 iso 0 dist 8.38394 6.72502 6.59374 8.60554 12.3994 6.99746 14.6259 17.8264 11.2485 8.4051 numMergedOcc 0
15 mol 24 unq 6 iso 0 dist 8.38394 6.72502 6.59374 8.60554 12.3994 6.99746 10.0952 12.5077 10.7114 7.29868 numMergedOcc 0
16 mol 24 unq 7 iso 0 dist 8.38394 6.72502 6.59374 9.44691 12.505 7.05541 14.6259 17.8264 11.2485 8.75662 numMergedOcc 0
17 mol 24 unq 8 iso 0 dist 5.54419 4.93188 4.33963 8.70827 5.59311 9.75636 12.3067 7.36323 9.24958 9.12854 numMergedOcc 0
18 mol 24 unq 9 iso 0 dist 5.54419 4.93188 4.33963 6.73939 12.176 10.0715 11.4989 15.5324 13.0257 9.41441 numMergedOcc 0
19 mol 24 unq 10 iso 0 dist 7.36323 9.24958 4.33963 9.12854 5.59311 9.75636 12.3067 5.54419 4.93188 8.70827 numMergedOcc 0
20 mol 25 unq 0 iso 0 dist 5.04899 6.6492 9.20601 7.45383 7.33728 11.7817 10.9391 11.9561 16.357 6.16347 numMergedOcc 0
21 mol 25 unq 1 iso 0 dist 7.57578 6.90155 9.36158 6.16347 9.34396 11.0508 10.9391 12.7009 17.3821 7.45383 numMergedOcc 0
22 mol 25 unq 2 iso 0 dist 7.57578 6.90155 9.36158 7.92503 6.11127 6.61233 10.6808 13.7311 5.81959 8.6653 numMergedOcc 0
23 mol 25 unq 3 iso 0 dist 7.17969 6.90155 10.1525 6.16347 10.8498 11.0508 10.9391 12.8117 17.3821 7.45383 numMergedOcc 0
24 mol 25 unq 4 iso 0 dist 7.17969 6.90155 10.1525 7.92503 5.30154 6.61233 10.6808 12.9968 5.81959 8.6653 numMergedOcc 0
25 mol 25 unq 5 iso 0 dist 7.31767 5.81959 7.63409 8.6653 5.64303 6.61233 10.6808 12.4135 6.90155 7.92503 numMergedOcc 0
26 mol 25 unq 6 iso 0 dist 6.03987 5.81959 8.4666 8.6653 5.82503 6.61233 10.6808 11.6743 6.90155 7.92503 numMergedOcc 0
27 mol 85 unq 0 iso 0 dist 7.95579 7.33422 6.82174 7.54568 10.2865 6.85215 10.1164 15.309 14.9249 9.39864 numMergedOcc 0
28 mol 85 unq 1 iso 0 dist 6.19965 7.33422 7.91778 7.54568 8.09967 6.85215 10.1164 11.2656 14.9249 9.39864 numMergedOcc 0
29 mol 85 unq 2 iso 0 dist 7.66905 7.33422 10.121 7.54568 4.65335 6.85215 10.1164 5.73196 14.9249 9.39864 numMergedOcc 0
30 mol 119 unq 0 iso 0 dist 8.73993 8.56342 4.91132 6.52773 7.20179 6.96805 4.85907 10.3704 7.99857 9.11344 numMergedOcc 0
31 mol 119 unq 1 iso 0 dist 8.73993 6.37542 6.08167 6.52773 7.20179 4.86811 4.85907 10.3704 10.4631 9.11344 numMergedOcc 0
32 mol 119 unq 2 iso 0 dist 9.87172 7.99857 7.61939 9.11344 10.9441 6.96805 4.85907 12.6489 8.56342 6.52773 numMergedOcc 0
33 mol 133 unq 0 iso 0 dist 6.29155 6.76699 5.74088 6.16242 4.54648 9.34112 7.81217 6.80239 11.1595 5.87634 numMergedOcc 0
34 mol 134 unq 0 iso 0 dist 6.54501 5.53031 5.35679 7.80532 7.41674 8.98004 5.79898 9.89303 10.0513 5.83771 numMergedOcc 0
35 mol 134 unq 1 iso 0 dist 6.49416 5.53031 8.46636 7.80532 9.87376 8.98004 5.79898 9.93925 10.0513 5.83771 numMergedOcc 0
36 mol 170 unq 0 iso 0 dist 9.76807 8.15099 7.72147 6.35982 4.34698 7.29587 6.52462 12.8696 9.05166 9.10511 numMergedOcc 0
37 mol 186 unq 0 iso 0 dist 7.54065 7.20574 8.90184 8.73217 11.7429 11.8992 14.5862 16.3985 19.2622 7.76163 numMergedOcc 0
38 mol 206 unq 0 iso 0 dist 8.02137 8.70977 6.3188 7.75885 12.7604 10.7023 5.63422 11.1804 12.3357 6.16414 numMergedOcc 0
39 mol 206 unq 1 iso 0 dist 9.774 8.70977 9.9412 7.75885 6.45859 10.7023 5.63422 7.7366 12.3357 6.16414 numMergedOcc 0
40 mol 227 unq 0 iso 0 dist 9.34734 8.03442 10.2525 7.43071 6.00424 12.8075 4.39704 10.4905 12.2278 6.02296 numMergedOcc 0
41 mol 227 unq 1 iso 0 dist 7.22101 8.03442 10.5813 7.43071 6.35849 12.8075 4.39704 7.09863 12.2278 6.02296 numMergedOcc 0
42 mol 227 unq 2 iso 0 dist 8.65997 8.03442 7.22396 7.43071 10.204 12.8075 4.39704 10.8157 12.2278 6.02296 numMergedOcc 0
43 mol 227 unq 3 iso 0 dist 7.56888 8.03442 6.10296 7.43071 9.76735 12.8075 4.39704 11.0431 12.2278 6.02296 numMergedOcc 0
44 mol 227 unq 4 iso 0 dist 7.55216 8.03442 9.69537 7.43071 9.32448 12.8075 4.39704 10.0334 12.2278 6.02296 numMergedOcc 0
45 mol 238 unq 0 iso 0 dist 5.72887 7.32982 12.3808 9.24557 14.7883 4.77308 10.0191 13.5431 6.66971 7.57812 numMergedOcc 0
46 mol 258 unq 0 iso 0 dist 6.60405 6.70815 7.42673 7.21311 5.63675 8.10604 12.321 10.5548 16.6122 9.63959 numMergedOcc 0
47 mol 258 unq 1 iso 0 dist 6.60405 6.70815 7.42673 7.21311 5.63675 8.10604 10.7374 14.3043 14.5215 9.96262 numMergedOcc 0
48 mol 259 unq 0 iso 0 dist 7.46176 8.55558 5.60748 7.08526 8.81835 6.31909 6.96053 7.88519 10.5803 7.98231 numMergedOcc 0
