0 mol 8 unq 0 iso 0 dist 8.96553 9.62879 8.4069 7.43529 7.3915 10.6335 4.36226 8.53529 7.18019 5.65816 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 7.63133 6.31718 10.8455 10.454 6.56335 15.6697 10.4366 16.9082 6.93532 20.8827 numMergedOcc 0
2 mol 19 unq 0 iso 0 dist 4.54938 8.4674 7.67038 5.18512 6.92532 10.1882 9.74255 7.75618 8.40416 13.9675 numMergedOcc 0
3 mol 19 unq 1 iso 0 dist 7.82074 8.4674 10.3915 5.18512 6.36455 10.1882 9.74255 12.3215 8.40416 13.9675 numMergedOcc 0
4 mol 19 unq 2 iso 0 dist 7.82074 4.54938 5.03957 5.18512 6.36455 6.92532 9.74255 12.3215 7.75618 13.9675 numMergedOcc 0
5 mol 19 unq 3 iso 0 dist 6.864 4.51865 7.67038 9.47529 6.92532 10.1882 7.08342 7.75618 8.40416 13.9675 numMergedOcc 0
6 mol 24 unq 0 iso 0 dist 8.86116 6.86014 10.0952 6.58998 6.72502 10.7114 4.32034 12.9284 7.33768 10.025 numMergedOcc 0
7 mol 24 unq 1 iso 0 dist 8.86116 6.86014 10.0952 6.58998 6.72502 10.7114 8.67951 13.4393 9.01567 9.14963 numMergedOcc 0
8 mol 24 unq 2 iso 0 dist 8.86116 6.86014 10.0952 6.58998 6.72502 10.7114 8.52463 8.60554 7.29868 6.99746 numMergedOcc 0
9 mol 24 unq 3 iso 0 dist 5.54419 7.36323 12.3067 4.33963 4.93188 9.24958 5.59311 8.70827 9.12854 9.75636 numMergedOcc 0
10 mol 24 unq 4 iso 0 dist 7.36323 5.54419 12.3067 4.33963 9.24958 4.93188 5.59311 9.12854 8.70827 9.75636 numMergedOcc 0
11 mol 24 unq 5 iso 0 dist 7.36323 5.54419 12.3067 4.33963 9.24958 4.93188 12.176 18.673 6.73939 10.0715 numMergedOcc 0
12 mol 43 unq 0 iso 0 dist 5.73819 6.20293 5.06502 5.48048 8.44903 10.0649 8.38399 12.3649 8.95682 10.3008 numMergedOcc 0
13 mol 60 unq 0 iso 0 dist 8.33063 8.7531 7.29309 9.62257 9.96399 7.55695 7.04075 10.5084 9.90939 4.82351 numMergedOcc 0
14 mol 85 unq 0 iso 0 dist 6.19965 7.97049 5.42586 7.91778 7.33422 12.3486 9.29301 12.0078 9.82915 16.6297 numMergedOcc 0
15 mol 85 unq 1 iso 0 dist 7.66905 7.47541 5.42586 10.121 7.33422 12.3486 13.5116 12.0078 9.82915 16.6297 numMergedOcc 0
16 mol 85 unq 2 iso 0 dist 7.66905 5.73196 10.1164 10.121 7.33422 14.9249 4.65335 7.54568 9.39864 6.85215 numMergedOcc 0
17 mol 131 unq 0 iso 0 dist 8.40312 6.85062 10.7062 5.89022 8.86329 11.6142 14.2045 18.0058 8.70296 17.3411 numMergedOcc 0
18 mol 131 unq 1 iso 0 dist 8.40312 6.85062 10.7062 5.89022 8.86329 11.6142 5.09131 13.44 9.25558 8.14183 numMergedOcc 0
19 mol 131 unq 2 iso 0 dist 7.12972 6.85062 6.63273 5.89022 8.71039 11.6142 14.2045 12.6227 8.70296 17.3411 numMergedOcc 0
20 mol 131 unq 3 iso 0 dist 7.12972 6.85062 6.63273 5.89022 8.71039 11.6142 5.09131 11.586 9.25558 8.14183 numMergedOcc 0
21 mol 131 unq 4 iso 0 dist 7.12972 6.85062 6.63273 9.32969 6.92648 9.29384 14.2045 12.6227 8.70296 10.8127 numMergedOcc 0
22 mol 131 unq 5 iso 0 dist 7.12972 6.85062 6.63273 9.32969 6.92648 9.29384 5.09131 11.586 9.25558 11.2516 numMergedOcc 0
23 mol 133 unq 0 iso 0 dist 6.29155 6.80239 7.81217 5.74088 6.76699 11.1595 4.54648 6.16242 5.87634 9.34112 numMergedOcc 0
24 mol 134 unq 0 iso 0 dist 6.54501 9.89303 5.79898 5.35679 5.53031 10.0513 7.41674 7.80532 5.83771 8.98004 numMergedOcc 0
25 mol 134 unq 1 iso 0 dist 8.94367 6.49416 8.80819 9.4027 8.20836 13.846 9.87376 10.5252 7.80532 14.2253 numMergedOcc 0
26 mol 181 unq 0 iso 0 dist 9.1374 8.03334 13.2049 13.8722 6.51749 15.2991 4.43096 12.4878 6.46704 17.0176 numMergedOcc 0
27 mol 181 unq 1 iso 0 dist 9.1374 8.03334 13.2049 13.8722 6.51749 15.2991 8.04639 10.6908 6.59025 11.1881 numMergedOcc 0
28 mol 181 unq 2 iso 0 dist 9.09537 5.98885 10.1912 5.93488 7.20392 6.51749 9.81073 18.0578 8.90963 13.0913 numMergedOcc 0
29 mol 186 unq 0 iso 0 dist 7.54065 9.70748 13.8792 8.90184 7.20574 18.0414 5.4141 12.4002 7.66165 14.0308 numMergedOcc 0
30 mol 186 unq 1 iso 0 dist 8.87694 9.70748 14.9058 8.90184 6.85302 18.0414 5.4141 14.0016 7.66165 14.0308 numMergedOcc 0
31 mol 186 unq 2 iso 0 dist 8.87694 9.70748 14.9058 12.8303 9.98215 20.9635 5.4141 14.0016 7.66165 17.0845 numMergedOcc 0
32 mol 186 unq 3 iso 0 dist 8.87694 7.54065 5.74635 8.90184 6.85302 7.20574 11.7429 14.2425 8.73217 11.8992 numMergedOcc 0
33 mol 186 unq 4 iso 0 dist 8.87694 7.54065 5.74635 12.8303 9.98215 13.6209 11.7429 14.2425 8.73217 19.3828 numMergedOcc 0
34 mol 205 unq 0 iso 0 dist 6.03031 7.26832 7.38516 5.28092 8.44861 5.60393 10.3603 12.3113 5.44002 8.46033 numMergedOcc 0
35 mol 206 unq 0 iso 0 dist 9.774 7.7366 5.63422 9.9412 8.70977 12.3357 6.45859 7.75885 6.16414 10.7023 numMergedOcc 0
36 mol 206 unq 1 iso 0 dist 9.774 7.7366 5.63422 9.9412 8.70977 12.3357 4.40897 11.4872 7.33701 13.8756 numMergedOcc 0
37 mol 206 unq 2 iso 0 dist 9.774 7.7366 5.63422 9.9412 8.70977 12.3357 7.62219 13.2041 8.0871 16.9443 numMergedOcc 0
38 mol 227 unq 0 iso 0 dist 7.22101 7.09863 4.39704 10.5813 8.03442 12.2278 6.35849 7.43071 6.02296 12.8075 numMergedOcc 0
39 mol 234 unq 0 iso 0 dist 9.45496 6.56247 5.88703 5.63086 7.5366 8.24186 4.46561 13.293 9.81425 9.68666 numMergedOcc 0
40 mol 234 unq 1 iso 0 dist 6.7625 9.36357 5.88703 5.6819 7.5366 8.24186 10.641 13.293 9.81425 9.68666 numMergedOcc 0
41 mol 258 unq 0 iso 0 dist 6.42289 6.60405 7.26417 7.42673 7.99477 6.70815 5.63675 11.2102 7.21311 8.10604 numMergedOcc 0
42 mol 258 unq 1 iso 0 dist 6.42289 6.60405 7.26417 6.44209 7.86627 11.184 5.63675 11.2102 7.21311 10.0353 numMergedOcc 0
43 mol 259 unq 0 iso 0 dist 7.46176 7.88519 6.96053 5.60748 8.55558 10.5803 8.81835 7.08526 7.98231 6.31909 numMergedOcc 0
