0 mol 11 unq 0 iso 0 dist 7.77766 8.09534 11.6473 9.88198 4.46511 12.158 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 5.36645 7.31914 7.34452 6.42242 8.82805 9.51443 numMergedOcc 0
2 mol 53 unq 0 iso 0 dist 8.94173 8.83047 13.3355 8.5021 9.59418 9.61785 numMergedOcc 0
3 mol 60 unq 0 iso 0 dist 8.8058 8.4928 9.62257 8.04272 7.04075 4.82351 numMergedOcc 0
4 mol 67 unq 0 iso 0 dist 7.9572 6.0478 5.6313 9.42982 4.3987 5.89161 numMergedOcc 0
5 mol 67 unq 1 iso 0 dist 7.9572 6.0478 5.6313 8.17929 9.9849 12.4415 numMergedOcc 0
6 mol 67 unq 2 iso 0 dist 7.9572 6.0478 5.6313 5.63802 10.0069 10.8112 numMergedOcc 0
7 mol 67 unq 3 iso 0 dist 8.64208 6.0478 4.72525 9.42982 9.67324 5.89161 numMergedOcc 0
8 mol 67 unq 4 iso 0 dist 8.64208 6.0478 4.72525 8.17929 14.5039 12.4415 numMergedOcc 0
9 mol 67 unq 5 iso 0 dist 8.64208 6.0478 4.72525 5.63802 13.6485 10.8112 numMergedOcc 0
10 mol 85 unq 0 iso 0 dist 9.22376 9.924 10.121 9.04728 4.65335 6.85215 numMergedOcc 0
11 mol 92 unq 0 iso 0 dist 6.30103 6.97288 4.24513 7.31426 8.51055 7.75408 numMergedOcc 0
12 mol 109 unq 0 iso 0 dist 7.4371 7.73993 11.8348 9.13614 7.20706 10.9279 numMergedOcc 0
13 mol 124 unq 0 iso 0 dist 7.23052 4.83761 9.70339 9.18949 14.8831 5.6462 numMergedOcc 0
14 mol 171 unq 0 iso 0 dist 6.01711 6.81707 5.487 6.4751 11.5561 9.18337 numMergedOcc 0
15 mol 171 unq 1 iso 0 dist 6.01711 6.81707 5.487 5.75085 10.844 8.83874 numMergedOcc 0
16 mol 173 unq 0 iso 0 dist 8.70197 7.70692 5.5127 8.79135 4.98294 7.59362 numMergedOcc 0
17 mol 173 unq 1 iso 0 dist 8.84671 4.0037 10.7924 9.31172 13.2996 11.4153 numMergedOcc 0
18 mol 188 unq 0 iso 0 dist 7.63268 9.53031 4.46081 9.26919 6.38128 10.7591 numMergedOcc 0
19 mol 239 unq 0 iso 0 dist 9.27989 9.36997 18.6229 6.91534 11.169 12.5953 numMergedOcc 0
20 mol 239 unq 1 iso 0 dist 9.27989 9.36997 18.6229 8.67704 14.8007 10.9512 numMergedOcc 0
21 mol 239 unq 2 iso 0 dist 9.27989 9.97907 17.6269 6.91534 11.169 11.4843 numMergedOcc 0
22 mol 239 unq 3 iso 0 dist 9.27989 9.97907 17.6269 8.67704 14.8007 7.06824 numMergedOcc 0
23 mol 239 unq 4 iso 0 dist 9.27989 8.83751 7.34872 6.91534 11.169 13.3917 numMergedOcc 0
24 mol 239 unq 5 iso 0 dist 9.27989 8.83751 7.34872 8.67704 14.8007 14.4176 numMergedOcc 0
25 mol 239 unq 6 iso 0 dist 9.27989 8.77688 8.9361 6.91534 11.169 9.38172 numMergedOcc 0
26 mol 239 unq 7 iso 0 dist 9.27989 8.77688 8.9361 8.67704 14.8007 9.33091 numMergedOcc 0
27 mol 250 unq 0 iso 0 dist 8.21206 9.48115 15.2098 8.85979 4.34713 14.352 numMergedOcc 0
28 mol 253 unq 0 iso 0 dist 7.80525 9.92698 10.4713 8.64294 11.5361 6.41774 numMergedOcc 0
29 mol 253 unq 1 iso 0 dist 7.71295 9.92698 6.89124 8.64294 10.8836 6.41774 numMergedOcc 0
30 mol 261 unq 0 iso 0 dist 7.6414 6.40153 8.57648 6.45102 6.18925 4.58184 numMergedOcc 0
31 mol 279 unq 0 iso 0 dist 6.47376 7.5355 6.15987 9.29922 12.6502 8.43508 numMergedOcc 0
32 mol 284 unq 0 iso 0 dist 6.86342 9.12227 7.09757 6.76508 5.69992 8.8928 numMergedOcc 0
33 mol 284 unq 1 iso 0 dist 8.08993 5.68818 6.4399 4.87349 10.6664 9.97867 numMergedOcc 0
34 mol 284 unq 2 iso 0 dist 7.34344 5.68818 13.016 4.87349 4.50325 9.97867 numMergedOcc 0
