0 mol 0 unq 0 iso 0 dist 7.31837 7.65884 8.34244 9.42137 5.24778 9.23213 11.2184 8.73015 8.66548 12.9149 numMergedOcc 0
1 mol 27 unq 0 iso 0 dist 5.66743 11.6846 7.60283 19.7162 14.3929 9.77484 16.9354 13.4461 6.78936 9.11842 numMergedOcc 0
2 mol 27 unq 1 iso 0 dist 7.42669 8.05284 7.60283 16.4314 14.3929 9.77484 11.0223 13.4461 6.78936 9.11842 numMergedOcc 0
3 mol 58 unq 0 iso 0 dist 5.84625 10.3974 7.6481 15.1543 9.62267 8.81638 11.0988 5.45005 8.13051 6.07871 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 7.69638 4.07863 9.43355 9.59244 11.1914 6.23899 11.2945 13.144 8.67634 4.53828 numMergedOcc 0
5 mol 119 unq 0 iso 0 dist 8.4733 6.02826 7.26955 7.91337 5.92984 7.39889 5.90003 10.3622 6.55202 6.30721 numMergedOcc 0
6 mol 119 unq 1 iso 0 dist 8.4733 6.02826 7.26955 7.91337 5.92984 7.39889 14.6053 14.9264 9.08536 14.443 numMergedOcc 0
7 mol 119 unq 2 iso 0 dist 8.4733 6.02826 7.26955 11.7745 15.5019 9.63176 5.90003 10.3622 6.55202 6.9194 numMergedOcc 0
8 mol 119 unq 3 iso 0 dist 8.4733 6.02826 7.26955 11.7745 15.5019 9.63176 14.6053 14.9264 9.08536 9.68677 numMergedOcc 0
9 mol 119 unq 4 iso 0 dist 8.4733 6.02826 7.26955 13.3911 10.314 7.44174 5.90003 10.3622 6.55202 12.4621 numMergedOcc 0
10 mol 119 unq 5 iso 0 dist 8.4733 6.02826 7.26955 13.3911 10.314 7.44174 14.6053 14.9264 9.08536 6.20019 numMergedOcc 0
11 mol 126 unq 0 iso 0 dist 8.97111 4.56139 7.36017 8.32241 6.0268 7.75534 11.2195 3.9234 8.7789 5.42561 numMergedOcc 0
12 mol 126 unq 1 iso 0 dist 8.97111 4.56139 7.36017 8.32241 6.0268 7.75534 12.9831 5.50104 9.93613 10.7549 numMergedOcc 0
13 mol 126 unq 2 iso 0 dist 8.97111 4.56139 7.36017 11.9998 10.1326 9.06011 11.2195 3.9234 8.7789 7.47528 numMergedOcc 0
14 mol 126 unq 3 iso 0 dist 8.97111 4.56139 7.36017 11.9998 10.1326 9.06011 12.9831 5.50104 9.93613 11.9496 numMergedOcc 0
15 mol 133 unq 0 iso 0 dist 6.42904 5.80615 6.51868 5.86531 5.92062 7.92688 13.5061 10.0161 9.10003 14.8533 numMergedOcc 0
16 mol 133 unq 1 iso 0 dist 7.31633 6.2062 7.34698 10.8427 6.61891 7.92688 11.9149 11.7838 9.10003 14.8533 numMergedOcc 0
17 mol 134 unq 0 iso 0 dist 5.49198 5.90631 6.93279 13.3013 14.2198 8.94837 9.13697 6.06606 5.52149 11.5407 numMergedOcc 0
18 mol 134 unq 1 iso 0 dist 5.49198 5.90631 6.93279 13.0519 11.147 7.77454 9.13697 6.06606 5.52149 5.91192 numMergedOcc 0
19 mol 173 unq 0 iso 0 dist 9.38737 10.5012 8.41245 14.1437 6.14414 7.93331 18.8624 16.0084 8.62366 12.4131 numMergedOcc 0
20 mol 173 unq 1 iso 0 dist 9.38737 10.5012 8.41245 14.1437 6.14414 7.93331 19.6349 13.8465 9.44973 8.85462 numMergedOcc 0
21 mol 173 unq 2 iso 0 dist 9.38737 10.5012 8.41245 14.1437 6.14414 7.93331 15.4922 11.2063 6.52508 6.91529 numMergedOcc 0
22 mol 173 unq 3 iso 0 dist 9.38737 10.5012 8.41245 12.8143 5.27321 6.98095 18.8624 16.0084 8.62366 12.5815 numMergedOcc 0
23 mol 173 unq 4 iso 0 dist 9.38737 10.5012 8.41245 12.8143 5.27321 6.98095 19.6349 13.8465 9.44973 9.65654 numMergedOcc 0
24 mol 173 unq 5 iso 0 dist 9.38737 10.5012 8.41245 12.8143 5.27321 6.98095 15.4922 11.2063 6.52508 9.44845 numMergedOcc 0
25 mol 173 unq 6 iso 0 dist 9.38737 10.5012 8.41245 17.2257 10.8609 8.31897 18.8624 16.0084 8.62366 8.63452 numMergedOcc 0
26 mol 173 unq 7 iso 0 dist 9.38737 10.5012 8.41245 17.2257 10.8609 8.31897 19.6349 13.8465 9.44973 4.83786 numMergedOcc 0
27 mol 173 unq 8 iso 0 dist 9.38737 10.5012 8.41245 17.2257 10.8609 8.31897 15.4922 11.2063 6.52508 3.74688 numMergedOcc 0
28 mol 173 unq 9 iso 0 dist 9.51638 12.905 6.64779 14.0294 4.72839 7.93331 13.9492 11.3761 8.62366 12.4131 numMergedOcc 0
29 mol 173 unq 10 iso 0 dist 9.51638 12.905 6.64779 14.0294 4.72839 7.93331 15.3514 9.90783 9.44973 8.85462 numMergedOcc 0
30 mol 173 unq 11 iso 0 dist 9.51638 12.905 6.64779 14.0294 4.72839 7.93331 9.26656 4.60149 6.52508 6.91529 numMergedOcc 0
31 mol 173 unq 12 iso 0 dist 9.51638 12.905 6.64779 17.3029 8.07089 6.98095 13.9492 11.3761 8.62366 12.5815 numMergedOcc 0
32 mol 173 unq 13 iso 0 dist 9.51638 12.905 6.64779 17.3029 8.07089 6.98095 15.3514 9.90783 9.44973 9.65654 numMergedOcc 0
33 mol 173 unq 14 iso 0 dist 9.51638 12.905 6.64779 17.3029 8.07089 6.98095 9.26656 4.60149 6.52508 9.44845 numMergedOcc 0
34 mol 173 unq 15 iso 0 dist 9.51638 12.905 6.64779 12.2385 5.70743 8.31897 13.9492 11.3761 8.62366 8.63452 numMergedOcc 0
35 mol 173 unq 16 iso 0 dist 9.51638 12.905 6.64779 12.2385 5.70743 8.31897 15.3514 9.90783 9.44973 4.83786 numMergedOcc 0
36 mol 173 unq 17 iso 0 dist 9.51638 12.905 6.64779 12.2385 5.70743 8.31897 9.26656 4.60149 6.52508 3.74688 numMergedOcc 0
37 mol 270 unq 0 iso 0 dist 8.55914 6.41275 7.89388 7.82003 5.43023 8.25349 12.1258 4.11153 9.85255 6.81241 numMergedOcc 0
38 mol 274 unq 0 iso 0 dist 6.83113 5.95459 9.20749 6.55855 5.64601 9.19234 4.97796 5.39432 6.66172 8.87855 numMergedOcc 0
