0 mol 8 unq 0 iso 0 dist 9.95165 15.9496 6.82379 8.95363 5.00267 11.0223 6.92865 5.02333 9.88063 7.8922 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 9.95165 14.678 6.24978 8.95363 5.00267 6.80407 6.92865 5.02333 11.0287 7.8922 numMergedOcc 0
2 mol 8 unq 2 iso 0 dist 9.95165 17.3707 9.66439 8.95363 5.00267 8.44094 6.92865 5.02333 14.5532 7.8922 numMergedOcc 0
3 mol 8 unq 3 iso 0 dist 9.95165 12.915 7.3915 8.95363 5.00267 6.32152 6.92865 5.02333 10.5239 7.8922 numMergedOcc 0
4 mol 8 unq 4 iso 0 dist 8.4444 5.95251 7.8922 7.20987 5.00267 5.02333 10.4545 11.0223 9.88063 6.82379 numMergedOcc 0
5 mol 8 unq 5 iso 0 dist 8.4444 5.95251 7.8922 7.20987 5.00267 5.02333 10.4255 6.80407 11.0287 6.24978 numMergedOcc 0
6 mol 8 unq 6 iso 0 dist 8.4444 5.95251 7.8922 7.20987 5.00267 5.02333 14.9792 8.44094 14.5532 9.66439 numMergedOcc 0
7 mol 8 unq 7 iso 0 dist 8.4444 5.95251 7.8922 7.20987 5.00267 5.02333 13.6972 6.32152 10.5239 7.3915 numMergedOcc 0
8 mol 24 unq 0 iso 0 dist 4.61828 9.20254 6.60423 13.674 9.38831 6.58998 10.4452 5.97304 8.86116 6.72502 numMergedOcc 0
9 mol 24 unq 1 iso 0 dist 4.61828 8.8926 7.83786 13.674 9.38831 11.0493 10.4452 5.97304 10.5273 6.72502 numMergedOcc 0
10 mol 115 unq 0 iso 0 dist 8.99731 7.64822 5.72642 4.64486 8.71286 7.21418 9.56867 7.3094 7.88312 5.74857 numMergedOcc 0
11 mol 119 unq 0 iso 0 dist 8.84146 13.7656 7.77116 16.2159 8.03035 4.91132 13.052 4.99056 10.3704 7.99857 numMergedOcc 0
12 mol 119 unq 1 iso 0 dist 8.84146 13.7656 7.77116 16.2159 8.03035 4.91132 10.2589 3.78311 8.73993 8.56342 numMergedOcc 0
13 mol 119 unq 2 iso 0 dist 8.84146 13.7656 7.77116 11.6573 7.6968 6.08167 10.2589 3.78311 8.73993 6.37542 numMergedOcc 0
14 mol 152 unq 0 iso 0 dist 9.19078 7.17016 9.77552 6.79236 6.39031 7.2238 13.1463 5.70788 10.399 8.35555 numMergedOcc 0
15 mol 152 unq 1 iso 0 dist 9.19078 11.3742 8.28642 6.79236 6.39031 5.59336 13.1463 5.70788 5.87555 8.35555 numMergedOcc 0
16 mol 156 unq 0 iso 0 dist 9.17868 9.72865 9.31851 7.59931 4.9941 10.7975 14.4092 5.82636 13.584 7.73169 numMergedOcc 0
17 mol 156 unq 1 iso 0 dist 9.17868 9.72865 9.31851 17.1327 8.06913 13.6634 14.4092 5.82636 13.584 5.38091 numMergedOcc 0
18 mol 156 unq 2 iso 0 dist 9.17868 9.85133 6.2319 7.59931 4.9941 5.71107 14.4092 5.82636 8.34702 7.73169 numMergedOcc 0
19 mol 156 unq 3 iso 0 dist 9.17868 9.85133 6.2319 17.1327 8.06913 10.7023 14.4092 5.82636 8.34702 5.38091 numMergedOcc 0
20 mol 156 unq 4 iso 0 dist 9.17868 15.9362 9.97732 7.59931 4.9941 11.2067 14.4092 5.82636 9.06726 7.73169 numMergedOcc 0
21 mol 156 unq 5 iso 0 dist 9.17868 15.9362 9.97732 17.1327 8.06913 9.00862 14.4092 5.82636 9.06726 5.38091 numMergedOcc 0
22 mol 186 unq 0 iso 0 dist 4.97005 11.3961 9.56197 10.0516 7.55358 9.27818 15.3487 12.7155 16.1971 7.20574 numMergedOcc 0
23 mol 186 unq 1 iso 0 dist 4.97005 11.3961 9.56197 10.0516 7.55358 9.27818 11.0743 9.97575 15.6447 6.85302 numMergedOcc 0
24 mol 186 unq 2 iso 0 dist 4.97005 11.3961 9.56197 5.57831 7.60991 9.55926 11.0743 9.97575 15.6447 9.98215 numMergedOcc 0
25 mol 186 unq 3 iso 0 dist 4.97005 10.0248 7.24795 10.0516 7.55358 13.0197 15.3487 12.7155 18.5854 7.20574 numMergedOcc 0
26 mol 186 unq 4 iso 0 dist 4.97005 10.0248 7.24795 10.0516 7.55358 13.0197 11.0743 9.97575 16.9992 6.85302 numMergedOcc 0
27 mol 186 unq 5 iso 0 dist 4.97005 10.0248 7.24795 5.57831 7.60991 12.9082 11.0743 9.97575 16.9992 9.98215 numMergedOcc 0
28 mol 186 unq 6 iso 0 dist 4.97005 9.14781 8.64409 10.0516 7.55358 4.37002 15.3487 12.7155 10.7914 7.20574 numMergedOcc 0
29 mol 186 unq 7 iso 0 dist 4.97005 9.14781 8.64409 10.0516 7.55358 4.37002 11.0743 9.97575 9.09754 6.85302 numMergedOcc 0
30 mol 186 unq 8 iso 0 dist 4.97005 9.14781 8.64409 5.57831 7.60991 4.64235 11.0743 9.97575 9.09754 9.98215 numMergedOcc 0
31 mol 186 unq 9 iso 0 dist 4.97005 6.69897 7.60202 10.0516 7.55358 9.72941 15.3487 12.7155 16.7729 7.20574 numMergedOcc 0
32 mol 186 unq 10 iso 0 dist 4.97005 6.69897 7.60202 10.0516 7.55358 9.72941 11.0743 9.97575 14.1487 6.85302 numMergedOcc 0
33 mol 186 unq 11 iso 0 dist 4.97005 6.69897 7.60202 5.57831 7.60991 5.39885 11.0743 9.97575 14.1487 9.98215 numMergedOcc 0
34 mol 225 unq 0 iso 0 dist 8.768 6.89798 6.6561 6.78745 6.53728 4.76151 14.0856 11.5135 13.3684 8.87609 numMergedOcc 0
35 mol 227 unq 0 iso 0 dist 9.33735 15.9389 8.38865 10.8608 9.56257 10.5813 17.255 11.0628 7.22101 8.03442 numMergedOcc 0
36 mol 227 unq 1 iso 0 dist 9.33735 10.8811 5.4694 10.8608 9.56257 7.22396 17.255 11.0628 8.65997 8.03442 numMergedOcc 0
37 mol 294 unq 0 iso 0 dist 9.21767 9.04205 7.91611 5.62181 7.41079 6.21267 11.4441 12.0308 14.9913 9.13907 numMergedOcc 0
38 mol 294 unq 1 iso 0 dist 6.16375 6.99988 7.91611 10.0223 7.41079 6.21267 17.2419 12.0308 14.9913 9.13907 numMergedOcc 0
