0 mol 16 unq 0 iso 0 dist 5.46498 7.63133 5.32694 8.71745 5.74188 10.4155 5.94084 6.58035 5.47769 12.1189 9.81307 11.1513 8.43054 16.7405 4.68733 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 5.46498 7.63133 5.32694 8.71745 5.74188 10.4155 6.73355 8.41862 13.0191 8.16785 9.81307 11.1513 8.43054 16.7405 15.0531 numMergedOcc 0
2 mol 16 unq 2 iso 0 dist 8.71745 7.63133 10.4155 5.46498 5.74188 5.32694 6.73355 8.16785 13.0191 8.41862 9.81307 16.7405 8.43054 11.1513 15.0531 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 6.20293 5.73819 5.06502 8.93915 6.45462 5.89973 9.49077 9.83618 13.5377 13.7177 5.07458 10.0168 6.66407 10.9975 14.3756 numMergedOcc 0
4 mol 58 unq 0 iso 0 dist 7.32874 6.81627 5.47421 9.55426 5.90225 9.7274 6.75888 6.40841 10.335 6.31428 5.61579 8.69057 5.38524 13.1897 11.0945 numMergedOcc 0
5 mol 58 unq 1 iso 0 dist 6.86465 6.62496 5.30792 6.35756 5.35073 4.81926 6.47744 8.63333 11.5023 8.89374 9.87158 13.3281 9.22598 8.96727 14.6599 numMergedOcc 0
6 mol 58 unq 2 iso 0 dist 6.86465 6.35756 5.35073 6.62496 5.30792 4.81926 6.47744 8.63333 8.89374 11.5023 9.87158 13.3281 8.96727 9.22598 14.6599 numMergedOcc 0
7 mol 58 unq 3 iso 0 dist 6.86465 6.35756 5.35073 6.62496 5.30792 4.81926 6.47744 8.63333 8.89374 11.5023 5.86526 11.5155 8.01308 9.55996 9.47022 numMergedOcc 0
8 mol 58 unq 4 iso 0 dist 6.62496 6.35756 4.81926 6.86465 5.30792 5.35073 4.67832 9.64665 9.66798 11.4118 9.87158 9.22598 8.96727 13.3281 8.59939 numMergedOcc 0
9 mol 58 unq 5 iso 0 dist 6.62496 6.35756 4.81926 6.86465 5.30792 5.35073 4.67832 9.64665 9.66798 11.4118 5.86526 9.55996 8.01308 11.5155 4.03439 numMergedOcc 0
10 mol 58 unq 6 iso 0 dist 6.35756 6.62496 4.81926 6.86465 5.35073 5.30792 6.47744 8.89374 11.5023 8.63333 9.87158 8.96727 9.22598 13.3281 14.6599 numMergedOcc 0
11 mol 58 unq 7 iso 0 dist 9.55426 6.81627 9.7274 7.32874 5.90225 5.47421 13.1021 9.73139 15.9764 10.9482 5.61579 13.1897 5.38524 8.69057 16.9237 numMergedOcc 0
12 mol 58 unq 8 iso 0 dist 9.55426 6.81627 9.7274 7.32874 5.90225 5.47421 6.75888 6.31428 10.335 6.40841 5.61579 13.1897 5.38524 8.69057 11.0945 numMergedOcc 0
13 mol 58 unq 9 iso 0 dist 9.55426 7.32874 5.90225 6.81627 9.7274 5.47421 13.1021 9.73139 10.9482 15.9764 5.61579 13.1897 8.69057 5.38524 16.9237 numMergedOcc 0
14 mol 58 unq 10 iso 0 dist 9.55426 7.32874 5.90225 6.81627 9.7274 5.47421 6.75888 6.31428 6.40841 10.335 5.61579 13.1897 8.69057 5.38524 11.0945 numMergedOcc 0
15 mol 73 unq 0 iso 0 dist 9.96396 6.19304 5.4148 8.70481 14.9342 13.3558 7.41074 8.70133 4.65521 15.9587 6.20232 12.2276 8.68662 13.8931 6.10063 numMergedOcc 0
16 mol 73 unq 1 iso 0 dist 9.96396 6.19304 5.4148 8.70481 14.9342 13.3558 7.41074 8.70133 4.65521 15.9587 5.70116 9.73086 7.4369 12.8207 6.15714 numMergedOcc 0
17 mol 73 unq 2 iso 0 dist 9.96396 8.70481 14.9342 6.19304 5.4148 13.3558 7.41074 8.70133 15.9587 4.65521 11.2069 13.3207 5.5087 13.8368 17.2861 numMergedOcc 0
18 mol 73 unq 3 iso 0 dist 9.96396 8.70481 14.9342 6.19304 5.4148 13.3558 7.41074 8.70133 15.9587 4.65521 10.6713 14.498 6.08682 14.5999 16.8311 numMergedOcc 0
19 mol 73 unq 4 iso 0 dist 6.19304 9.96396 5.4148 8.70481 13.3558 14.9342 7.41074 4.65521 8.70133 15.9587 5.70116 7.4369 9.73086 12.8207 6.15714 numMergedOcc 0
20 mol 73 unq 5 iso 0 dist 6.19304 8.70481 13.3558 9.96396 5.4148 14.9342 7.41074 4.65521 15.9587 8.70133 11.2069 13.8368 5.5087 13.3207 17.2861 numMergedOcc 0
21 mol 73 unq 6 iso 0 dist 6.19304 8.70481 13.3558 9.96396 5.4148 14.9342 7.41074 4.65521 15.9587 8.70133 10.6713 14.5999 6.08682 14.498 16.8311 numMergedOcc 0
22 mol 100 unq 0 iso 0 dist 7.47343 6.65086 8.8807 6.56369 12.6515 7.80879 10.1589 8.72704 10.5193 15.8984 6.23008 9.76432 8.91882 11.5088 6.13211 numMergedOcc 0
23 mol 100 unq 1 iso 0 dist 7.47343 6.65086 8.8807 9.30209 13.887 5.38414 10.1589 8.72704 10.5193 14.8726 6.23008 9.76432 8.91882 11.6812 6.13211 numMergedOcc 0
24 mol 115 unq 0 iso 0 dist 5.83991 7.30858 10.8507 7.88312 8.02349 11.5723 10.9739 7.76729 17.6696 12.9821 5.03039 10.5599 6.04595 11.8378 15.1254 numMergedOcc 0
25 mol 115 unq 1 iso 0 dist 7.88312 7.30858 11.5723 5.83991 8.02349 10.8507 11.7126 6.99777 11.695 13.9977 5.03039 11.8378 6.04595 10.5599 13.2709 numMergedOcc 0
26 mol 115 unq 2 iso 0 dist 7.88312 7.30858 11.5723 5.83991 8.02349 10.8507 4.62962 9.14376 10.0603 9.65429 5.03039 11.8378 6.04595 10.5599 5.53947 numMergedOcc 0
27 mol 115 unq 3 iso 0 dist 7.88312 5.83991 8.02349 7.30858 11.5723 10.8507 11.7126 6.99777 13.9977 11.695 6.01673 10.0255 6.24825 13.22 15.7303 numMergedOcc 0
28 mol 115 unq 4 iso 0 dist 7.88312 5.83991 8.02349 7.30858 11.5723 10.8507 4.62962 9.14376 9.65429 10.0603 6.01673 10.0255 6.24825 13.22 6.70178 numMergedOcc 0
29 mol 117 unq 0 iso 0 dist 7.90328 7.83136 7.22206 7.0603 9.3584 7.21564 4.91401 6.62561 7.63616 10.6107 3.55765 10.4223 8.19331 8.85711 5.56883 numMergedOcc 0
30 mol 117 unq 1 iso 0 dist 7.90328 7.0603 9.3584 7.83136 7.22206 7.21564 4.91401 6.62561 10.6107 7.63616 3.55765 10.4223 8.85711 8.19331 5.56883 numMergedOcc 0
31 mol 117 unq 2 iso 0 dist 7.83136 7.90328 7.22206 7.0603 7.21564 9.3584 4.91401 7.63616 6.62561 10.6107 10.5783 11.6387 6.10127 14.762 6.95589 numMergedOcc 0
32 mol 117 unq 3 iso 0 dist 7.83136 7.0603 7.21564 7.90328 7.22206 9.3584 4.91401 7.63616 10.6107 6.62561 3.55765 8.19331 8.85711 10.4223 5.56883 numMergedOcc 0
33 mol 131 unq 0 iso 0 dist 7.12972 8.40312 5.55373 6.85062 6.63273 10.7062 6.19596 8.6243 12.5969 6.91348 3.98662 10.0551 9.27976 10.7579 9.23774 numMergedOcc 0
34 mol 131 unq 1 iso 0 dist 6.85062 8.40312 10.7062 7.12972 6.63273 5.55373 6.19596 6.91348 12.5969 8.6243 3.98662 10.7579 9.27976 10.0551 9.23774 numMergedOcc 0
35 mol 131 unq 2 iso 0 dist 6.85062 8.40312 10.7062 7.12972 6.63273 5.55373 6.6499 9.51418 13.6559 12.9472 3.98662 10.7579 9.27976 10.0551 7.17459 numMergedOcc 0
36 mol 134 unq 0 iso 0 dist 8.94367 6.37586 5.49782 6.49416 8.80819 5.00817 5.41704 8.79571 5.42582 8.6355 6.95573 13.9752 9.33924 9.55584 6.0991 numMergedOcc 0
37 mol 134 unq 1 iso 0 dist 8.94367 6.37586 5.49782 6.49416 8.80819 5.00817 5.41704 8.79571 5.42582 8.6355 8.06642 7.21868 7.93372 11.988 5.67107 numMergedOcc 0
38 mol 134 unq 2 iso 0 dist 6.37586 8.94367 5.49782 6.49416 5.00817 8.80819 5.41704 5.42582 8.79571 8.6355 8.06642 7.93372 7.21868 11.988 5.67107 numMergedOcc 0
39 mol 134 unq 3 iso 0 dist 6.49416 8.94367 8.80819 6.37586 5.00817 5.49782 5.41704 8.6355 8.79571 5.42582 8.06642 11.988 7.21868 7.93372 5.67107 numMergedOcc 0
40 mol 134 unq 4 iso 0 dist 6.49416 6.37586 5.00817 8.94367 8.80819 5.49782 5.41704 8.6355 5.42582 8.79571 6.95573 9.55584 9.33924 13.9752 6.0991 numMergedOcc 0
41 mol 134 unq 5 iso 0 dist 6.49416 6.37586 5.00817 8.94367 8.80819 5.49782 5.41704 8.6355 5.42582 8.79571 8.06642 11.988 7.93372 7.21868 5.67107 numMergedOcc 0
42 mol 181 unq 0 iso 0 dist 5.98885 9.1374 8.88798 9.15386 5.16002 12.1628 5.4601 7.20046 10.2276 11.968 12.9532 13.2783 9.76212 18.2853 9.37649 numMergedOcc 0
43 mol 181 unq 1 iso 0 dist 5.98885 9.1374 8.88798 9.15386 5.16002 12.1628 10.0524 7.13543 10.7636 11.8099 12.9532 13.2783 9.76212 18.2853 9.04392 numMergedOcc 0
44 mol 181 unq 2 iso 0 dist 9.15386 9.1374 12.1628 5.98885 5.16002 8.88798 8.25067 9.6668 13.2702 10.8351 12.9532 18.2853 9.76212 13.2783 20.3687 numMergedOcc 0
45 mol 224 unq 0 iso 0 dist 8.95269 6.57273 4.70378 5.78342 11.5372 8.49799 9.36098 7.06793 10.0414 12.7072 7.05804 13.2325 8.79428 6.8692 16.0684 numMergedOcc 0
46 mol 224 unq 1 iso 0 dist 8.95269 6.57273 4.70378 5.78342 11.5372 8.49799 5.29877 6.67585 6.65984 10.667 7.05804 13.2325 8.79428 6.8692 10.9705 numMergedOcc 0
47 mol 224 unq 2 iso 0 dist 8.95269 5.78342 11.5372 6.57273 4.70378 8.49799 9.36098 7.06793 12.7072 10.0414 7.05804 13.2325 6.8692 8.79428 16.0684 numMergedOcc 0
48 mol 224 unq 3 iso 0 dist 8.95269 5.78342 11.5372 6.57273 4.70378 8.49799 5.29877 6.67585 10.667 6.65984 7.05804 13.2325 6.8692 8.79428 10.9705 numMergedOcc 0
49 mol 224 unq 4 iso 0 dist 6.57273 5.78342 8.49799 8.95269 4.70378 11.5372 5.29877 6.65984 10.667 6.67585 7.05804 8.79428 6.8692 13.2325 10.9705 numMergedOcc 0
50 mol 224 unq 5 iso 0 dist 6.60589 6.65832 6.77699 9.16166 8.49799 11.328 6.12232 6.65984 11.0097 10.667 5.76843 8.79428 6.99769 6.8692 10.9705 numMergedOcc 0
51 mol 224 unq 6 iso 0 dist 6.60589 9.16166 8.49799 6.65832 6.77699 11.328 6.12232 6.65984 10.667 11.0097 5.76843 8.79428 6.8692 6.99769 10.9705 numMergedOcc 0
52 mol 227 unq 0 iso 0 dist 7.22101 8.65997 5.22356 9.34734 6.99063 7.60506 6.43754 8.17891 6.95902 12.4085 5.0317 5.23634 6.91318 10.7855 4.09934 numMergedOcc 0
53 mol 227 unq 1 iso 0 dist 7.22101 8.65997 5.22356 7.56888 10.8658 9.70012 6.43754 8.17891 6.95902 11.004 5.0317 5.23634 6.91318 11.2661 4.09934 numMergedOcc 0
54 mol 227 unq 2 iso 0 dist 7.22101 8.65997 5.22356 7.55216 12.4689 12.9332 6.43754 8.17891 6.95902 12.8864 5.0317 5.23634 6.91318 12.3663 4.09934 numMergedOcc 0
55 mol 227 unq 3 iso 0 dist 8.65997 7.22101 5.22356 9.34734 7.60506 6.99063 14.6185 9.62609 13.4493 17.0949 5.0317 6.91318 5.23634 10.7855 11.5454 numMergedOcc 0
56 mol 227 unq 4 iso 0 dist 8.65997 7.22101 5.22356 9.34734 7.60506 6.99063 6.43754 6.95902 8.17891 12.4085 5.0317 6.91318 5.23634 10.7855 4.09934 numMergedOcc 0
57 mol 227 unq 5 iso 0 dist 8.65997 7.22101 5.22356 7.56888 9.70012 10.8658 14.6185 9.62609 13.4493 16.5207 5.0317 6.91318 5.23634 11.2661 11.5454 numMergedOcc 0
58 mol 227 unq 6 iso 0 dist 8.65997 7.22101 5.22356 7.56888 9.70012 10.8658 6.43754 6.95902 8.17891 11.004 5.0317 6.91318 5.23634 11.2661 4.09934 numMergedOcc 0
59 mol 227 unq 7 iso 0 dist 8.65997 7.22101 5.22356 7.55216 12.9332 12.4689 14.6185 9.62609 13.4493 19.8174 5.0317 6.91318 5.23634 12.3663 11.5454 numMergedOcc 0
60 mol 227 unq 8 iso 0 dist 8.65997 7.22101 5.22356 7.55216 12.9332 12.4689 6.43754 6.95902 8.17891 12.8864 5.0317 6.91318 5.23634 12.3663 4.09934 numMergedOcc 0
61 mol 227 unq 9 iso 0 dist 7.55216 7.22101 12.4689 9.34734 9.51866 6.99063 11.662 8.83563 15.9414 14.4583 5.0317 12.3663 5.23634 10.7855 15.9047 numMergedOcc 0
62 mol 227 unq 10 iso 0 dist 7.55216 7.22101 12.4689 8.65997 12.9332 5.22356 11.662 8.83563 15.9414 18.8667 5.0317 12.3663 5.23634 6.91318 15.9047 numMergedOcc 0
63 mol 227 unq 11 iso 0 dist 7.55216 7.22101 12.4689 7.56888 4.48529 10.8658 11.662 8.83563 15.9414 12.9801 5.0317 12.3663 5.23634 11.2661 15.9047 numMergedOcc 0
64 mol 227 unq 12 iso 0 dist 7.55216 8.65997 12.9332 9.34734 9.51866 7.60506 11.662 8.83563 18.8667 14.4583 5.0317 12.3663 6.91318 10.7855 15.9047 numMergedOcc 0
65 mol 227 unq 13 iso 0 dist 7.55216 8.65997 12.9332 7.22101 12.4689 5.22356 11.662 8.83563 18.8667 15.9414 5.0317 12.3663 6.91318 5.23634 15.9047 numMergedOcc 0
66 mol 227 unq 14 iso 0 dist 7.55216 8.65997 12.9332 7.56888 4.48529 9.70012 11.662 8.83563 18.8667 12.9801 5.0317 12.3663 6.91318 11.2661 15.9047 numMergedOcc 0
67 mol 252 unq 0 iso 0 dist 8.33025 7.19638 14.9102 9.2288 8.41807 11.7918 9.37715 7.66365 14.7097 10.165 7.40852 13.1298 7.15764 10.5687 9.43777 numMergedOcc 0
