0 mol 7 unq 0 iso 0 dist 8.88982 16.991 9.67164 20.7193 12.2041 5.99459 20.7235 13.5184 4.7739 5.51421 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.8576 5.33843 5.99459 14.6878 12.2041 9.67164 20.1229 20.3971 16.6461 9.8603 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 6.00307 11.2808 9.48085 13.1745 10.9391 9.49421 8.65485 8.40051 13.591 8.6396 numMergedOcc 0
3 mol 30 unq 0 iso 0 dist 9.28346 4.02928 6.07517 10.7688 5.34368 6.74179 4.41825 9.44073 3.65941 8.609 numMergedOcc 0
4 mol 62 unq 0 iso 0 dist 6.56664 5.68713 9.69044 9.58156 8.62608 6.9103 11.1016 14.3699 5.46563 8.1599 numMergedOcc 0
5 mol 62 unq 1 iso 0 dist 7.99003 6.72919 9.69044 9.89555 8.62608 6.9103 11.1205 14.3699 5.46563 8.1599 numMergedOcc 0
6 mol 62 unq 2 iso 0 dist 9.96382 3.78856 9.69044 7.59416 8.62608 6.9103 7.04908 14.3699 5.46563 8.1599 numMergedOcc 0
7 mol 76 unq 0 iso 0 dist 8.51543 5.4968 6.72869 15.1609 10.2879 9.85905 21.7182 17.86 16.3337 8.58841 numMergedOcc 0
8 mol 78 unq 0 iso 0 dist 9.45835 7.18645 6.85523 10.3301 7.19663 8.65848 12.0085 13.9943 9.89481 9.10981 numMergedOcc 0
9 mol 88 unq 0 iso 0 dist 8.25679 5.7326 7.51139 12.8811 12.1547 7.80898 14.2171 17.1552 10.0429 9.72689 numMergedOcc 0
10 mol 88 unq 1 iso 0 dist 8.25679 5.7326 7.51139 12.8811 12.1547 7.80898 13.3672 14.2965 11.151 7.74197 numMergedOcc 0
11 mol 115 unq 0 iso 0 dist 5.22628 3.82475 6.39384 11.2519 7.69052 9.42082 15.2887 12.5189 12.6105 5.02717 numMergedOcc 0
12 mol 218 unq 0 iso 0 dist 9.85348 9.15328 7.33709 14.1454 4.72474 8.75536 12.2182 7.73315 3.5359 7.0843 numMergedOcc 0
13 mol 218 unq 1 iso 0 dist 9.85348 9.15328 7.33709 12.2392 5.61978 6.67404 12.2182 7.73315 3.5359 6.9398 numMergedOcc 0
14 mol 234 unq 0 iso 0 dist 7.14333 4.84686 5.64285 4.91961 10.2693 7.81215 5.55026 11.8838 9.8663 7.86368 numMergedOcc 0
15 mol 259 unq 0 iso 0 dist 6.20344 5.13757 7.66153 5.29682 4.69778 9.07743 6.00285 9.73107 9.54522 5.90645 numMergedOcc 0
16 mol 277 unq 0 iso 0 dist 9.64889 15.23 8.9682 11.1337 11.8268 9.57499 14.0094 19.3912 17.8399 9.77689 numMergedOcc 0
17 mol 277 unq 1 iso 0 dist 9.64889 15.23 8.9682 11.1337 11.8268 9.57499 12.2908 9.71491 6.17642 8.51931 numMergedOcc 0
18 mol 277 unq 2 iso 0 dist 9.64889 15.23 8.9682 12.6823 7.08227 5.46926 12.2908 9.71491 6.17642 8.96343 numMergedOcc 0
19 mol 277 unq 3 iso 0 dist 9.64889 15.0167 6.92711 12.6823 7.08227 5.13913 12.2908 9.71491 8.24206 8.96343 numMergedOcc 0
20 mol 277 unq 4 iso 0 dist 6.70123 15.3157 9.57499 13.8031 7.69449 5.46926 11.7666 8.51931 6.17642 8.96343 numMergedOcc 0
21 mol 277 unq 5 iso 0 dist 6.70123 15.3157 9.57499 15.6541 11.8268 8.9682 20.4573 17.8158 12.2421 9.29635 numMergedOcc 0
22 mol 292 unq 0 iso 0 dist 7.11081 5.37135 7.30758 13.7129 10.3106 9.9182 21.6044 19.0288 18.4042 9.6898 numMergedOcc 0
23 mol 292 unq 1 iso 0 dist 7.11081 5.37135 7.30758 13.7129 10.3106 9.9182 11.7304 10.9895 6.65781 5.75596 numMergedOcc 0
24 mol 292 unq 2 iso 0 dist 7.11081 5.37135 7.30758 13.7138 12.6861 9.10788 11.7304 10.9895 6.65781 8.37867 numMergedOcc 0
25 mol 292 unq 3 iso 0 dist 8.99442 6.17318 9.9182 10.2717 12.1693 9.10788 4.09108 5.75596 6.65781 8.37867 numMergedOcc 0
26 mol 292 unq 4 iso 0 dist 8.99442 4.77323 8.9221 10.2717 12.1693 8.85064 4.09108 5.75596 4.00064 8.37867 numMergedOcc 0
