0 mol 58 unq 0 iso 0 dist 6.81627 7.32874 5.47421 9.55426 9.7274 5.90225 8.26899 5.98837 4.55117 10.3782 5.61579 5.38524 8.69057 13.1897 7.03126 numMergedOcc 0
1 mol 58 unq 0 iso 1 dist 6.81627 9.55426 9.7274 7.32874 5.47421 5.90225 8.26899 5.98837 10.3782 4.55117 5.61579 5.38524 13.1897 8.69057 7.03126 numMergedOcc 0
2 mol 58 unq 1 iso 0 dist 7.32874 6.81627 5.47421 9.55426 5.90225 9.7274 8.26899 4.55117 5.98837 10.3782 5.61579 8.69057 5.38524 13.1897 7.03126 numMergedOcc 0
3 mol 58 unq 1 iso 1 dist 7.32874 9.55426 5.90225 6.81627 5.47421 9.7274 8.26899 4.55117 10.3782 5.98837 5.61579 8.69057 13.1897 5.38524 7.03126 numMergedOcc 0
4 mol 58 unq 2 iso 0 dist 6.62496 6.86465 5.30792 6.35756 4.81926 5.35073 9.58673 10.2241 5.92889 7.05413 9.87158 9.22598 13.3281 8.96727 15.7229 numMergedOcc 0
5 mol 58 unq 2 iso 1 dist 6.62496 6.35756 4.81926 6.86465 5.30792 5.35073 9.58673 10.2241 7.05413 5.92889 9.87158 9.22598 8.96727 13.3281 15.7229 numMergedOcc 0
6 mol 58 unq 3 iso 0 dist 6.35756 6.86465 5.35073 6.62496 4.81926 5.30792 9.58673 7.05413 5.92889 10.2241 9.87158 8.96727 13.3281 9.22598 15.7229 numMergedOcc 0
7 mol 58 unq 3 iso 1 dist 6.35756 6.62496 4.81926 6.86465 5.35073 5.30792 9.58673 7.05413 10.2241 5.92889 9.87158 8.96727 9.22598 13.3281 15.7229 numMergedOcc 0
8 mol 58 unq 4 iso 0 dist 6.35756 6.86465 5.35073 6.62496 4.81926 5.30792 9.58673 7.05413 5.92889 10.2241 5.86526 8.01308 11.5155 9.55996 12.8612 numMergedOcc 0
9 mol 58 unq 4 iso 1 dist 6.35756 6.62496 4.81926 6.86465 5.35073 5.30792 9.58673 7.05413 10.2241 5.92889 5.86526 8.01308 9.55996 11.5155 12.8612 numMergedOcc 0
10 mol 85 unq 0 iso 0 dist 7.66905 7.47541 5.42586 5.73196 10.1164 6.87425 7.22293 11.6116 7.98917 6.47779 5.59906 7.7068 10.2413 11.2056 10.7558 numMergedOcc 0
11 mol 85 unq 0 iso 1 dist 7.66905 5.73196 10.1164 7.47541 5.42586 6.87425 7.22293 11.6116 6.47779 7.98917 5.59906 7.7068 11.2056 10.2413 10.7558 numMergedOcc 0
12 mol 100 unq 0 iso 0 dist 9.60661 7.17106 11.5403 9.35224 7.80879 8.87654 6.58204 10.9608 5.01145 5.69137 4.03277 8.91882 10.5432 11.5088 10.259 numMergedOcc 0
13 mol 100 unq 0 iso 1 dist 9.60661 9.35224 7.80879 7.17106 11.5403 8.87654 6.58204 10.9608 5.69137 5.01145 4.03277 8.91882 11.5088 10.5432 10.259 numMergedOcc 0
14 mol 100 unq 1 iso 0 dist 7.47343 6.65086 8.8807 6.56369 12.6515 7.80879 7.75343 15.209 10.9608 5.69137 5.9143 7.82475 11.9928 10.694 11.3652 numMergedOcc 0
15 mol 100 unq 1 iso 1 dist 7.47343 6.56369 12.6515 6.65086 8.8807 7.80879 7.75343 15.209 5.69137 10.9608 5.9143 7.82475 10.694 11.9928 11.3652 numMergedOcc 0
16 mol 100 unq 2 iso 0 dist 7.47343 6.65086 8.8807 6.56369 12.6515 7.80879 7.75343 15.209 10.9608 5.69137 5.47563 5.35782 9.94341 9.82522 12.1809 numMergedOcc 0
17 mol 100 unq 2 iso 1 dist 7.47343 6.56369 12.6515 6.65086 8.8807 7.80879 7.75343 15.209 5.69137 10.9608 5.47563 5.35782 9.82522 9.94341 12.1809 numMergedOcc 0
18 mol 100 unq 3 iso 0 dist 7.47343 6.65086 8.8807 9.30209 13.887 5.38414 7.75343 15.209 10.9608 9.21622 5.9143 7.82475 11.9928 14.966 11.3652 numMergedOcc 0
19 mol 100 unq 3 iso 1 dist 7.47343 9.30209 13.887 6.65086 8.8807 5.38414 7.75343 15.209 9.21622 10.9608 5.9143 7.82475 14.966 11.9928 11.3652 numMergedOcc 0
20 mol 100 unq 4 iso 0 dist 7.47343 6.65086 8.8807 9.30209 13.887 5.38414 7.75343 15.209 10.9608 9.21622 5.47563 5.35782 9.94341 13.4844 12.1809 numMergedOcc 0
21 mol 100 unq 4 iso 1 dist 7.47343 9.30209 13.887 6.65086 8.8807 5.38414 7.75343 15.209 9.21622 10.9608 5.47563 5.35782 13.4844 9.94341 12.1809 numMergedOcc 0
22 mol 100 unq 3 iso 0 dist 7.47343 6.56369 12.6515 9.30209 13.887 6.39938 7.75343 15.209 5.69137 9.21622 5.9143 7.82475 10.694 14.966 11.3652 numMergedOcc 0
23 mol 100 unq 3 iso 1 dist 7.47343 9.30209 13.887 6.56369 12.6515 6.39938 7.75343 15.209 9.21622 5.69137 5.9143 7.82475 14.966 10.694 11.3652 numMergedOcc 0
24 mol 100 unq 4 iso 0 dist 7.47343 6.56369 12.6515 9.30209 13.887 6.39938 7.75343 15.209 5.69137 9.21622 5.47563 5.35782 9.82522 13.4844 12.1809 numMergedOcc 0
25 mol 100 unq 4 iso 1 dist 7.47343 9.30209 13.887 6.56369 12.6515 6.39938 7.75343 15.209 9.21622 5.69137 5.47563 5.35782 13.4844 9.82522 12.1809 numMergedOcc 0
26 mol 100 unq 5 iso 0 dist 6.65086 7.47343 8.8807 6.56369 7.80879 12.6515 7.75343 10.9608 15.209 5.69137 6.23008 8.91882 9.76432 11.5088 10.259 numMergedOcc 0
27 mol 100 unq 5 iso 1 dist 6.65086 6.56369 7.80879 7.47343 8.8807 12.6515 7.75343 10.9608 5.69137 15.209 6.23008 8.91882 11.5088 9.76432 10.259 numMergedOcc 0
28 mol 100 unq 6 iso 0 dist 6.65086 7.47343 8.8807 9.30209 5.38414 13.887 7.75343 10.9608 15.209 9.21622 6.23008 8.91882 9.76432 11.6812 10.259 numMergedOcc 0
29 mol 100 unq 6 iso 1 dist 6.65086 9.30209 5.38414 7.47343 8.8807 13.887 7.75343 10.9608 9.21622 15.209 6.23008 8.91882 11.6812 9.76432 10.259 numMergedOcc 0
30 mol 100 unq 6 iso 0 dist 6.65086 6.56369 7.80879 9.30209 5.38414 6.39938 7.75343 10.9608 5.69137 9.21622 6.23008 8.91882 11.5088 11.6812 10.259 numMergedOcc 0
31 mol 100 unq 6 iso 1 dist 6.65086 9.30209 5.38414 6.56369 7.80879 6.39938 7.75343 10.9608 9.21622 5.69137 6.23008 8.91882 11.6812 11.5088 10.259 numMergedOcc 0
32 mol 115 unq 0 iso 0 dist 7.30858 5.83991 10.8507 7.88312 11.5723 8.02349 8.66155 11.3902 6.09023 4.61908 5.03039 6.04595 10.5599 11.8378 13.0432 numMergedOcc 0
33 mol 115 unq 0 iso 1 dist 7.30858 7.88312 11.5723 5.83991 10.8507 8.02349 8.66155 11.3902 4.61908 6.09023 5.03039 6.04595 11.8378 10.5599 13.0432 numMergedOcc 0
34 mol 115 unq 1 iso 0 dist 5.83991 7.30858 10.8507 7.88312 8.02349 11.5723 8.66155 6.09023 11.3902 4.61908 6.01673 6.24825 13.22 10.0255 10.8109 numMergedOcc 0
35 mol 115 unq 1 iso 1 dist 5.83991 7.88312 8.02349 7.30858 10.8507 11.5723 8.66155 6.09023 4.61908 11.3902 6.01673 6.24825 10.0255 13.22 10.8109 numMergedOcc 0
36 mol 152 unq 0 iso 0 dist 8.56324 6.70283 7.65448 7.16148 10.6875 5.49936 9.13561 5.99333 8.25411 7.89109 5.39112 6.59889 6.70693 10.4895 10.5081 numMergedOcc 0
37 mol 152 unq 0 iso 1 dist 8.56324 7.16148 10.6875 6.70283 7.65448 5.49936 9.13561 5.99333 7.89109 8.25411 5.39112 6.59889 10.4895 6.70693 10.5081 numMergedOcc 0
38 mol 152 unq 1 iso 0 dist 8.56324 6.70283 7.65448 7.16148 10.6875 5.49936 9.13561 5.99333 8.25411 7.89109 4.84714 8.9192 9.27706 11.6735 12.0501 numMergedOcc 0
39 mol 152 unq 1 iso 1 dist 8.56324 7.16148 10.6875 6.70283 7.65448 5.49936 9.13561 5.99333 7.89109 8.25411 4.84714 8.9192 11.6735 9.27706 12.0501 numMergedOcc 0
40 mol 152 unq 2 iso 0 dist 6.70283 8.56324 7.65448 7.16148 5.49936 10.6875 9.13561 8.25411 5.99333 7.89109 5.39112 6.70693 6.59889 10.4895 10.5081 numMergedOcc 0
41 mol 152 unq 2 iso 1 dist 6.70283 7.16148 5.49936 8.56324 7.65448 10.6875 9.13561 8.25411 7.89109 5.99333 5.39112 6.70693 10.4895 6.59889 10.5081 numMergedOcc 0
42 mol 178 unq 0 iso 0 dist 6.69288 6.43573 5.34677 7.17202 11.7381 9.89739 8.96511 10.5783 5.96647 12.075 6.42973 7.06025 10.0638 13.2692 12.6109 numMergedOcc 0
43 mol 178 unq 0 iso 1 dist 6.69288 7.17202 11.7381 6.43573 5.34677 9.89739 8.96511 10.5783 12.075 5.96647 6.42973 7.06025 13.2692 10.0638 12.6109 numMergedOcc 0
44 mol 178 unq 1 iso 0 dist 6.69288 6.43573 5.34677 8.81551 14.0703 10.5529 8.96511 10.5783 5.96647 9.92132 6.42973 7.06025 10.0638 15.0672 12.6109 numMergedOcc 0
45 mol 178 unq 1 iso 1 dist 6.69288 8.81551 14.0703 6.43573 5.34677 10.5529 8.96511 10.5783 9.92132 5.96647 6.42973 7.06025 15.0672 10.0638 12.6109 numMergedOcc 0
46 mol 178 unq 1 iso 0 dist 6.69288 7.17202 11.7381 8.81551 14.0703 5.18005 8.96511 10.5783 12.075 9.92132 6.42973 7.06025 13.2692 15.0672 12.6109 numMergedOcc 0
47 mol 178 unq 1 iso 1 dist 6.69288 8.81551 14.0703 7.17202 11.7381 5.18005 8.96511 10.5783 9.92132 12.075 6.42973 7.06025 15.0672 13.2692 12.6109 numMergedOcc 0
48 mol 181 unq 0 iso 0 dist 9.1374 5.98885 8.88798 9.15386 12.1628 5.16002 6.94688 6.25083 5.86342 6.80228 12.9532 9.76212 13.2783 18.2853 14.5897 numMergedOcc 0
49 mol 181 unq 0 iso 1 dist 9.1374 9.15386 12.1628 5.98885 8.88798 5.16002 6.94688 6.25083 6.80228 5.86342 12.9532 9.76212 18.2853 13.2783 14.5897 numMergedOcc 0
50 mol 181 unq 1 iso 0 dist 9.1374 5.98885 8.88798 9.15386 12.1628 5.16002 6.71012 4.77278 9.14057 11.6919 12.9532 9.76212 13.2783 18.2853 12.3788 numMergedOcc 0
51 mol 181 unq 1 iso 1 dist 9.1374 9.15386 12.1628 5.98885 8.88798 5.16002 6.71012 4.77278 11.6919 9.14057 12.9532 9.76212 18.2853 13.2783 12.3788 numMergedOcc 0
52 mol 222 unq 0 iso 0 dist 7.21333 8.01589 13.3522 7.7699 5.24516 10.4579 6.82208 12.2813 4.8892 11.0074 6.84862 5.56538 14.4477 10.0233 11.8745 numMergedOcc 0
53 mol 222 unq 0 iso 1 dist 7.21333 7.7699 5.24516 8.01589 13.3522 10.4579 6.82208 12.2813 11.0074 4.8892 6.84862 5.56538 10.0233 14.4477 11.8745 numMergedOcc 0
54 mol 222 unq 1 iso 0 dist 7.21333 8.01589 13.3522 7.7699 5.24516 10.4579 6.82208 12.2813 4.8892 11.0074 9.53117 7.48954 16.3082 11.839 12.9858 numMergedOcc 0
55 mol 222 unq 1 iso 1 dist 7.21333 7.7699 5.24516 8.01589 13.3522 10.4579 6.82208 12.2813 11.0074 4.8892 9.53117 7.48954 11.839 16.3082 12.9858 numMergedOcc 0
56 mol 224 unq 0 iso 0 dist 6.57273 8.95269 4.70378 5.78342 8.49799 11.5372 6.87664 7.12232 7.98696 5.3621 7.05804 8.79428 13.2325 6.8692 10.8888 numMergedOcc 0
57 mol 224 unq 0 iso 1 dist 6.57273 5.78342 8.49799 8.95269 4.70378 11.5372 6.87664 7.12232 5.3621 7.98696 7.05804 8.79428 6.8692 13.2325 10.8888 numMergedOcc 0
58 mol 224 unq 1 iso 0 dist 5.78342 8.95269 11.5372 6.57273 8.49799 4.70378 6.87664 5.3621 7.98696 7.12232 7.05804 6.8692 13.2325 8.79428 10.8888 numMergedOcc 0
59 mol 224 unq 1 iso 1 dist 5.78342 6.57273 8.49799 8.95269 11.5372 4.70378 6.87664 5.3621 7.12232 7.98696 7.05804 6.8692 8.79428 13.2325 10.8888 numMergedOcc 0
60 mol 248 unq 0 iso 0 dist 7.69895 7.21521 5.55137 8.2965 10.8081 5.86196 6.07192 6.48757 5.51827 9.29921 4.58289 9.05018 9.33962 11.4547 5.0345 numMergedOcc 0
61 mol 248 unq 0 iso 1 dist 7.69895 8.2965 10.8081 7.21521 5.55137 5.86196 6.07192 6.48757 9.29921 5.51827 4.58289 9.05018 11.4547 9.33962 5.0345 numMergedOcc 0
62 mol 259 unq 0 iso 0 dist 7.88519 7.84554 4.86771 7.46176 6.96053 7.64658 7.48005 11.6195 11.8736 5.79468 11.6988 9.46361 12.8903 6.95511 9.43105 numMergedOcc 0
63 mol 259 unq 0 iso 1 dist 7.88519 7.46176 6.96053 7.84554 4.86771 7.64658 7.48005 11.6195 5.79468 11.8736 11.6988 9.46361 6.95511 12.8903 9.43105 numMergedOcc 0
64 mol 259 unq 1 iso 0 dist 7.88519 7.84554 4.86771 9.18903 10.4881 5.87173 7.48005 11.6195 11.8736 12.6649 11.6988 9.46361 12.8903 17.104 9.43105 numMergedOcc 0
65 mol 259 unq 1 iso 1 dist 7.88519 9.18903 10.4881 7.84554 4.86771 5.87173 7.48005 11.6195 12.6649 11.8736 11.6988 9.46361 17.104 12.8903 9.43105 numMergedOcc 0
66 mol 259 unq 1 iso 0 dist 7.88519 7.46176 6.96053 9.18903 10.4881 10.5239 7.48005 11.6195 5.79468 12.6649 11.6988 9.46361 6.95511 17.104 9.43105 numMergedOcc 0
67 mol 259 unq 1 iso 1 dist 7.88519 9.18903 10.4881 7.46176 6.96053 10.5239 7.48005 11.6195 12.6649 5.79468 11.6988 9.46361 17.104 6.95511 9.43105 numMergedOcc 0
68 mol 259 unq 2 iso 0 dist 7.46176 7.88519 6.96053 7.84554 7.64658 4.86771 7.48005 5.79468 11.6195 11.8736 10.067 5.85442 10.3406 12.8546 6.23661 numMergedOcc 0
69 mol 259 unq 2 iso 1 dist 7.46176 7.84554 7.64658 7.88519 6.96053 4.86771 7.48005 5.79468 11.8736 11.6195 10.067 5.85442 12.8546 10.3406 6.23661 numMergedOcc 0
70 mol 259 unq 3 iso 0 dist 7.46176 7.88519 6.96053 7.84554 7.64658 4.86771 7.48005 5.79468 11.6195 11.8736 11.6988 6.95511 9.46361 12.8903 9.43105 numMergedOcc 0
71 mol 259 unq 3 iso 1 dist 7.46176 7.84554 7.64658 7.88519 6.96053 4.86771 7.48005 5.79468 11.8736 11.6195 11.6988 6.95511 12.8903 9.46361 9.43105 numMergedOcc 0
72 mol 259 unq 4 iso 0 dist 7.46176 7.88519 6.96053 9.18903 10.5239 10.4881 7.48005 5.79468 11.6195 12.6649 10.067 5.85442 10.3406 16.0301 6.23661 numMergedOcc 0
73 mol 259 unq 4 iso 1 dist 7.46176 9.18903 10.5239 7.88519 6.96053 10.4881 7.48005 5.79468 12.6649 11.6195 10.067 5.85442 16.0301 10.3406 6.23661 numMergedOcc 0
74 mol 259 unq 5 iso 0 dist 7.46176 7.88519 6.96053 9.18903 10.5239 10.4881 7.48005 5.79468 11.6195 12.6649 11.6988 6.95511 9.46361 17.104 9.43105 numMergedOcc 0
75 mol 259 unq 5 iso 1 dist 7.46176 9.18903 10.5239 7.88519 6.96053 10.4881 7.48005 5.79468 12.6649 11.6195 11.6988 6.95511 17.104 9.46361 9.43105 numMergedOcc 0
76 mol 259 unq 4 iso 0 dist 7.46176 7.84554 7.64658 9.18903 10.5239 5.87173 7.48005 5.79468 11.8736 12.6649 10.067 5.85442 12.8546 16.0301 6.23661 numMergedOcc 0
77 mol 259 unq 4 iso 1 dist 7.46176 9.18903 10.5239 7.84554 7.64658 5.87173 7.48005 5.79468 12.6649 11.8736 10.067 5.85442 16.0301 12.8546 6.23661 numMergedOcc 0
78 mol 259 unq 5 iso 0 dist 7.46176 7.84554 7.64658 9.18903 10.5239 5.87173 7.48005 5.79468 11.8736 12.6649 11.6988 6.95511 12.8903 17.104 9.43105 numMergedOcc 0
79 mol 259 unq 5 iso 1 dist 7.46176 9.18903 10.5239 7.84554 7.64658 5.87173 7.48005 5.79468 12.6649 11.8736 11.6988 6.95511 17.104 12.8903 9.43105 numMergedOcc 0
