0 mol 0 unq 0 iso 0 dist 7.31837 7.65884 8.34244 11.2184 8.73015 8.66548 numMergedOcc 0
1 mol 1 unq 0 iso 0 dist 9.76602 9.84669 7.83632 11.3817 3.81243 5.91417 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 8.99751 6.77783 6.15893 9.90986 5.29055 9.06516 numMergedOcc 0
3 mol 26 unq 1 iso 0 dist 8.99751 6.77783 6.15893 13.0329 6.64374 6.79475 numMergedOcc 0
4 mol 26 unq 2 iso 0 dist 9.44507 6.77783 5.497 9.90986 4.76998 9.06516 numMergedOcc 0
5 mol 26 unq 3 iso 0 dist 9.44507 6.77783 5.497 13.0329 5.39199 6.79475 numMergedOcc 0
6 mol 26 unq 4 iso 0 dist 9.30674 5.24037 6.15893 11.9218 5.29055 9.06516 numMergedOcc 0
7 mol 26 unq 5 iso 0 dist 9.30674 5.24037 6.15893 11.8673 6.64374 6.79475 numMergedOcc 0
8 mol 26 unq 6 iso 0 dist 8.25567 4.82659 6.15893 12.6141 5.29055 9.06516 numMergedOcc 0
9 mol 26 unq 7 iso 0 dist 8.25567 4.82659 6.15893 9.22183 6.64374 6.79475 numMergedOcc 0
10 mol 27 unq 0 iso 0 dist 5.66743 11.6846 7.60283 16.9354 13.4461 6.78936 numMergedOcc 0
11 mol 27 unq 1 iso 0 dist 7.42669 8.05284 7.60283 11.0223 13.4461 6.78936 numMergedOcc 0
12 mol 41 unq 0 iso 0 dist 5.31016 5.14132 6.73801 8.0072 4.23447 7.29079 numMergedOcc 0
13 mol 58 unq 0 iso 0 dist 5.84625 10.3974 7.6481 11.0988 5.45005 8.13051 numMergedOcc 0
14 mol 59 unq 0 iso 0 dist 7.69638 4.07863 9.43355 11.2945 13.144 8.67634 numMergedOcc 0
15 mol 62 unq 0 iso 0 dist 8.2746 12.1095 6.04903 10.8449 4.09232 9.1062 numMergedOcc 0
16 mol 98 unq 0 iso 0 dist 5.94696 9.47873 6.0129 5.08983 3.92737 4.44979 numMergedOcc 0
17 mol 98 unq 1 iso 0 dist 5.94696 9.47873 6.0129 9.58039 3.94967 6.61111 numMergedOcc 0
18 mol 114 unq 0 iso 0 dist 8.96382 4.7832 5.79343 9.87348 4.08391 5.51885 numMergedOcc 0
19 mol 119 unq 0 iso 0 dist 8.4733 6.02826 7.26955 5.90003 10.3622 6.55202 numMergedOcc 0
20 mol 119 unq 1 iso 0 dist 8.4733 6.02826 7.26955 14.6053 14.9264 9.08536 numMergedOcc 0
21 mol 126 unq 0 iso 0 dist 8.97111 4.56139 7.36017 11.2195 3.9234 8.7789 numMergedOcc 0
22 mol 126 unq 1 iso 0 dist 8.97111 4.56139 7.36017 12.9831 5.50104 9.93613 numMergedOcc 0
23 mol 128 unq 0 iso 0 dist 6.03154 8.80709 6.98158 10.7203 5.91388 6.47811 numMergedOcc 0
24 mol 133 unq 0 iso 0 dist 5.56565 4.49984 7.41399 12.3021 11.4316 8.55349 numMergedOcc 0
25 mol 133 unq 1 iso 0 dist 6.16862 4.49984 8.21165 12.3021 12.3375 8.55349 numMergedOcc 0
26 mol 133 unq 2 iso 0 dist 9.70325 6.16425 8.21165 14.6844 12.3375 8.55349 numMergedOcc 0
27 mol 133 unq 3 iso 0 dist 6.42904 5.80615 6.51868 13.5061 10.0161 9.10003 numMergedOcc 0
28 mol 133 unq 4 iso 0 dist 7.31633 6.2062 7.34698 11.9149 11.7838 9.10003 numMergedOcc 0
29 mol 134 unq 0 iso 0 dist 5.49198 5.90631 6.93279 9.13697 6.06606 5.52149 numMergedOcc 0
30 mol 157 unq 0 iso 0 dist 9.30128 9.06676 6.455 11.5255 3.89036 6.4431 numMergedOcc 0
31 mol 167 unq 0 iso 0 dist 9.14629 4.0737 7.80054 11.1687 5.43662 9.1326 numMergedOcc 0
32 mol 167 unq 1 iso 0 dist 9.14629 4.0737 7.80054 6.48993 5.95858 7.30954 numMergedOcc 0
33 mol 168 unq 0 iso 0 dist 8.90876 6.39941 7.60254 7.30338 4.02702 7.06851 numMergedOcc 0
34 mol 173 unq 0 iso 0 dist 9.38737 10.5012 8.41245 18.8624 16.0084 8.62366 numMergedOcc 0
35 mol 173 unq 1 iso 0 dist 9.38737 10.5012 8.41245 19.6349 13.8465 9.44973 numMergedOcc 0
36 mol 173 unq 2 iso 0 dist 9.38737 10.5012 8.41245 15.4922 11.2063 6.52508 numMergedOcc 0
37 mol 173 unq 3 iso 0 dist 9.51638 12.905 6.64779 13.9492 11.3761 8.62366 numMergedOcc 0
38 mol 173 unq 4 iso 0 dist 9.51638 12.905 6.64779 15.3514 9.90783 9.44973 numMergedOcc 0
39 mol 173 unq 5 iso 0 dist 9.51638 12.905 6.64779 9.26656 4.60149 6.52508 numMergedOcc 0
40 mol 195 unq 0 iso 0 dist 8.13947 4.04021 9.82588 9.48766 5.66395 9.32333 numMergedOcc 0
41 mol 243 unq 0 iso 0 dist 8.55613 10.4928 7.12785 16.957 10.1372 9.33476 numMergedOcc 0
42 mol 270 unq 0 iso 0 dist 8.55914 6.41275 7.89388 12.1258 4.11153 9.85255 numMergedOcc 0
43 mol 273 unq 0 iso 0 dist 9.78826 13.7838 8.85779 11.7289 10.5462 9.35749 numMergedOcc 0
44 mol 274 unq 0 iso 0 dist 6.83113 5.95459 9.20749 4.97796 5.39432 6.66172 numMergedOcc 0
45 mol 287 unq 0 iso 0 dist 7.76945 4.26276 5.59555 10.251 5.97664 8.59762 numMergedOcc 0
46 mol 288 unq 0 iso 0 dist 7.76945 4.26276 5.59555 10.251 5.97664 8.59762 numMergedOcc 0
47 mol 289 unq 0 iso 0 dist 7.76945 4.26276 5.59555 10.251 5.97664 8.59762 numMergedOcc 0
48 mol 292 unq 0 iso 0 dist 6.60049 7.69175 5.7131 7.78796 3.92782 6.1905 numMergedOcc 0
49 mol 292 unq 1 iso 0 dist 6.60049 7.69175 5.7131 11.3673 5.93687 5.84792 numMergedOcc 0
50 mol 292 unq 2 iso 0 dist 6.60049 7.69175 5.7131 14.9066 9.40023 8.73515 numMergedOcc 0
