0 mol 19 unq 0 iso 0 dist 7.20519 4.54938 7.34551 5.5841 9.80108 9.58539 10.3056 9.32205 13.8916 8.19695 8.7083 11.877 13.0732 4.01494 6.41656 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 7.20519 4.54938 7.34551 5.5841 9.80108 9.58539 7.75618 4.96411 9.74255 7.02548 8.7083 11.877 13.0732 4.01494 8.54034 numMergedOcc 0
2 mol 19 unq 2 iso 0 dist 7.20519 6.864 7.07775 5.5841 9.80108 8.58657 10.3056 9.32205 13.0631 8.19695 8.7083 11.877 12.2354 4.01494 6.41656 numMergedOcc 0
3 mol 19 unq 3 iso 0 dist 7.20519 6.864 7.07775 5.5841 9.80108 8.58657 7.75618 4.96411 7.08342 7.02548 8.7083 11.877 12.2354 4.01494 8.54034 numMergedOcc 0
4 mol 19 unq 4 iso 0 dist 4.51865 8.4674 5.80928 6.74265 8.58657 9.58539 13.287 13.0631 13.8916 8.19695 10.4416 12.2354 13.0732 4.01494 6.41656 numMergedOcc 0
5 mol 19 unq 5 iso 0 dist 4.51865 8.4674 5.80928 6.74265 8.58657 9.58539 8.40416 7.08342 9.74255 7.02548 10.4416 12.2354 13.0732 4.01494 8.54034 numMergedOcc 0
6 mol 19 unq 6 iso 0 dist 6.864 7.20519 7.07775 5.5841 8.58657 9.80108 10.3056 13.0631 9.32205 8.19695 8.7083 12.2354 11.877 4.01494 6.41656 numMergedOcc 0
7 mol 19 unq 7 iso 0 dist 6.864 7.20519 7.07775 5.5841 8.58657 9.80108 7.75618 7.08342 4.96411 7.02548 8.7083 12.2354 11.877 4.01494 8.54034 numMergedOcc 0
8 mol 19 unq 8 iso 0 dist 6.864 4.54938 5.80928 5.5841 8.58657 9.58539 10.3056 13.0631 13.8916 8.19695 8.7083 12.2354 13.0732 4.01494 6.41656 numMergedOcc 0
9 mol 19 unq 9 iso 0 dist 6.864 4.54938 5.80928 5.5841 8.58657 9.58539 7.75618 7.08342 9.74255 7.02548 8.7083 12.2354 13.0732 4.01494 8.54034 numMergedOcc 0
10 mol 58 unq 0 iso 0 dist 6.86465 6.62496 5.30792 6.47744 8.63333 11.5023 8.80614 10.2049 9.95364 9.11258 11.3019 15.888 13.813 13.2208 7.58739 numMergedOcc 0
11 mol 58 unq 1 iso 0 dist 6.86465 6.62496 5.30792 6.47744 8.63333 11.5023 8.80614 10.2049 9.95364 9.11258 9.87158 13.3281 9.22598 14.6599 9.01564 numMergedOcc 0
12 mol 58 unq 2 iso 0 dist 6.86465 6.62496 5.30792 6.47744 8.63333 11.5023 8.80614 10.2049 9.95364 9.11258 5.86526 11.5155 9.55996 9.47022 7.11065 numMergedOcc 0
13 mol 58 unq 3 iso 0 dist 6.86465 6.35756 5.35073 6.47744 8.63333 8.89374 8.80614 10.2049 5.49591 9.11258 11.3019 15.888 11.2189 13.2208 7.58739 numMergedOcc 0
14 mol 58 unq 4 iso 0 dist 6.86465 6.35756 5.35073 6.47744 8.63333 8.89374 8.80614 10.2049 5.49591 9.11258 9.87158 13.3281 8.96727 14.6599 9.01564 numMergedOcc 0
15 mol 58 unq 5 iso 0 dist 6.86465 6.35756 5.35073 6.47744 8.63333 8.89374 8.80614 10.2049 5.49591 9.11258 5.86526 11.5155 8.01308 9.47022 7.11065 numMergedOcc 0
16 mol 58 unq 6 iso 0 dist 6.35756 6.86465 5.35073 6.47744 8.89374 8.63333 8.80614 5.49591 10.2049 9.11258 11.3019 11.2189 15.888 13.2208 7.58739 numMergedOcc 0
17 mol 58 unq 7 iso 0 dist 6.35756 6.86465 5.35073 6.47744 8.89374 8.63333 8.80614 5.49591 10.2049 9.11258 9.87158 8.96727 13.3281 14.6599 9.01564 numMergedOcc 0
18 mol 58 unq 8 iso 0 dist 6.35756 6.86465 5.35073 6.47744 8.89374 8.63333 8.80614 5.49591 10.2049 9.11258 5.86526 8.01308 11.5155 9.47022 7.11065 numMergedOcc 0
19 mol 58 unq 9 iso 0 dist 6.35756 6.62496 4.81926 6.47744 8.89374 11.5023 8.80614 5.49591 9.95364 9.11258 11.3019 11.2189 13.813 13.2208 7.58739 numMergedOcc 0
20 mol 58 unq 10 iso 0 dist 6.35756 6.62496 4.81926 6.47744 8.89374 11.5023 8.80614 5.49591 9.95364 9.11258 9.87158 8.96727 9.22598 14.6599 9.01564 numMergedOcc 0
21 mol 58 unq 11 iso 0 dist 6.35756 6.62496 4.81926 6.47744 8.89374 11.5023 8.80614 5.49591 9.95364 9.11258 5.86526 8.01308 9.55996 9.47022 7.11065 numMergedOcc 0
22 mol 58 unq 12 iso 0 dist 6.64012 9.4099 6.47414 5.24906 6.46761 9.73139 9.86039 5.85698 12.2123 9.11258 11.8885 11.7132 17.8156 13.2208 7.58739 numMergedOcc 0
23 mol 58 unq 13 iso 0 dist 6.64012 9.4099 6.47414 5.24906 6.46761 9.73139 9.86039 5.85698 12.2123 9.11258 15.802 14.4498 20.9029 14.6599 9.01564 numMergedOcc 0
24 mol 58 unq 14 iso 0 dist 6.64012 9.4099 6.47414 5.24906 6.46761 9.73139 9.86039 5.85698 12.2123 9.11258 10.0319 10.6166 16.7574 9.47022 7.11065 numMergedOcc 0
25 mol 58 unq 15 iso 0 dist 9.4099 6.64012 6.47414 5.24906 9.73139 6.46761 9.86039 12.2123 5.85698 9.11258 11.8885 17.8156 11.7132 13.2208 7.58739 numMergedOcc 0
26 mol 58 unq 16 iso 0 dist 9.4099 6.64012 6.47414 5.24906 9.73139 6.46761 9.86039 12.2123 5.85698 9.11258 15.802 20.9029 14.4498 14.6599 9.01564 numMergedOcc 0
27 mol 58 unq 17 iso 0 dist 9.4099 6.64012 6.47414 5.24906 9.73139 6.46761 9.86039 12.2123 5.85698 9.11258 10.0319 16.7574 10.6166 9.47022 7.11065 numMergedOcc 0
28 mol 58 unq 18 iso 0 dist 9.55426 6.81627 9.7274 13.1021 9.73139 15.9764 18.8985 12.2123 21.5025 9.11258 21.9344 17.8156 26.2507 13.2208 7.58739 numMergedOcc 0
29 mol 58 unq 19 iso 0 dist 9.55426 6.81627 9.7274 13.1021 9.73139 15.9764 18.8985 12.2123 21.5025 9.11258 26.2291 20.9029 29.6336 14.6599 9.01564 numMergedOcc 0
30 mol 58 unq 20 iso 0 dist 9.55426 6.81627 9.7274 13.1021 9.73139 15.9764 18.8985 12.2123 21.5025 9.11258 20.6246 16.7574 24.6162 9.47022 7.11065 numMergedOcc 0
31 mol 58 unq 21 iso 0 dist 9.55426 7.32874 5.90225 13.1021 9.73139 10.9482 18.8985 12.2123 16.7404 9.11258 21.9344 17.8156 22.0258 13.2208 7.58739 numMergedOcc 0
32 mol 58 unq 22 iso 0 dist 9.55426 7.32874 5.90225 13.1021 9.73139 10.9482 18.8985 12.2123 16.7404 9.11258 26.2291 20.9029 24.6694 14.6599 9.01564 numMergedOcc 0
33 mol 58 unq 23 iso 0 dist 9.55426 7.32874 5.90225 13.1021 9.73139 10.9482 18.8985 12.2123 16.7404 9.11258 20.6246 16.7574 19.8584 9.47022 7.11065 numMergedOcc 0
34 mol 73 unq 0 iso 0 dist 9.96396 6.19304 5.4148 7.41074 8.70133 4.65521 9.24757 5.11416 6.56633 7.10439 6.20232 12.2276 8.68662 6.10063 8.96616 numMergedOcc 0
35 mol 73 unq 1 iso 0 dist 9.96396 6.19304 5.4148 7.41074 8.70133 4.65521 9.24757 5.11416 6.56633 7.10439 5.70116 9.73086 7.4369 6.15714 6.14542 numMergedOcc 0
36 mol 73 unq 2 iso 0 dist 9.96396 8.70481 14.9342 7.41074 8.70133 15.9587 9.24757 5.11416 15.3808 7.10439 6.20232 12.2276 13.8931 6.10063 8.96616 numMergedOcc 0
37 mol 73 unq 3 iso 0 dist 9.96396 8.70481 14.9342 7.41074 8.70133 15.9587 9.24757 5.11416 15.3808 7.10439 5.70116 9.73086 12.8207 6.15714 6.14542 numMergedOcc 0
38 mol 73 unq 4 iso 0 dist 6.19304 9.96396 5.4148 7.41074 4.65521 8.70133 9.24757 6.56633 5.11416 7.10439 6.20232 8.68662 12.2276 6.10063 8.96616 numMergedOcc 0
39 mol 73 unq 5 iso 0 dist 6.19304 9.96396 5.4148 7.41074 4.65521 8.70133 9.24757 6.56633 5.11416 7.10439 5.70116 7.4369 9.73086 6.15714 6.14542 numMergedOcc 0
40 mol 73 unq 6 iso 0 dist 6.19304 8.70481 13.3558 7.41074 4.65521 15.9587 9.24757 6.56633 15.3808 7.10439 6.20232 8.68662 13.8931 6.10063 8.96616 numMergedOcc 0
41 mol 73 unq 7 iso 0 dist 6.19304 8.70481 13.3558 7.41074 4.65521 15.9587 9.24757 6.56633 15.3808 7.10439 5.70116 7.4369 12.8207 6.15714 6.14542 numMergedOcc 0
42 mol 100 unq 0 iso 0 dist 7.47343 6.65086 8.8807 10.1589 8.72704 10.5193 9.5074 10.6245 6.71012 6.0652 12.0341 12.4084 13.2137 4.22932 7.81446 numMergedOcc 0
43 mol 100 unq 1 iso 0 dist 7.47343 6.65086 8.8807 10.1589 8.72704 10.5193 9.5074 10.6245 6.71012 6.0652 6.23008 9.76432 8.91882 6.13211 6.55173 numMergedOcc 0
44 mol 100 unq 2 iso 0 dist 7.47343 6.56369 12.6515 10.1589 8.72704 15.8984 9.5074 10.6245 13.0596 6.0652 12.0341 12.4084 17.5792 4.22932 7.81446 numMergedOcc 0
45 mol 100 unq 3 iso 0 dist 7.47343 6.56369 12.6515 10.1589 8.72704 15.8984 9.5074 10.6245 13.0596 6.0652 6.23008 9.76432 11.5088 6.13211 6.55173 numMergedOcc 0
46 mol 100 unq 4 iso 0 dist 7.47343 9.30209 13.887 10.1589 8.72704 14.8726 9.5074 10.6245 9.97598 6.0652 12.0341 12.4084 16.5929 4.22932 7.81446 numMergedOcc 0
47 mol 100 unq 5 iso 0 dist 7.47343 9.30209 13.887 10.1589 8.72704 14.8726 9.5074 10.6245 9.97598 6.0652 6.23008 9.76432 11.6812 6.13211 6.55173 numMergedOcc 0
48 mol 134 unq 0 iso 0 dist 6.54501 9.89303 5.79898 10.1448 8.6355 12.0514 7.69991 5.71679 4.60632 8.73604 12.847 11.988 13.0242 5.67107 9.0176 numMergedOcc 0
49 mol 134 unq 1 iso 0 dist 8.94367 6.37586 5.49782 5.41704 8.79571 5.42582 6.23142 4.57832 5.29786 8.73604 8.06642 7.21868 7.93372 5.67107 9.0176 numMergedOcc 0
50 mol 134 unq 2 iso 0 dist 8.94367 6.49416 8.80819 5.41704 8.79571 8.6355 6.23142 4.57832 5.71679 8.73604 8.06642 7.21868 11.988 5.67107 9.0176 numMergedOcc 0
51 mol 134 unq 3 iso 0 dist 6.37586 8.94367 5.49782 5.41704 5.42582 8.79571 6.23142 5.29786 4.57832 8.73604 8.06642 7.93372 7.21868 5.67107 9.0176 numMergedOcc 0
52 mol 134 unq 4 iso 0 dist 6.37586 6.49416 5.00817 5.41704 5.42582 8.6355 6.23142 5.29786 5.71679 8.73604 8.06642 7.93372 11.988 5.67107 9.0176 numMergedOcc 0
53 mol 134 unq 5 iso 0 dist 6.49416 8.94367 8.80819 5.41704 8.6355 8.79571 6.23142 5.71679 4.57832 8.73604 8.06642 11.988 7.21868 5.67107 9.0176 numMergedOcc 0
54 mol 134 unq 6 iso 0 dist 6.49416 6.37586 5.00817 5.41704 8.6355 5.42582 6.23142 5.71679 5.29786 8.73604 8.06642 11.988 7.93372 5.67107 9.0176 numMergedOcc 0
55 mol 134 unq 7 iso 0 dist 9.86662 9.71307 5.49782 6.17103 8.79571 5.42582 9.94764 4.57832 5.29786 8.73604 4.00092 7.21868 7.93372 5.67107 9.0176 numMergedOcc 0
56 mol 134 unq 8 iso 0 dist 9.71307 9.86662 5.49782 6.17103 5.42582 8.79571 9.94764 5.29786 4.57832 8.73604 4.00092 7.93372 7.21868 5.67107 9.0176 numMergedOcc 0
57 mol 155 unq 0 iso 0 dist 6.23493 7.46303 5.71071 6.3845 7.16254 9.14392 10.9606 10.4923 6.89781 9.0529 9.16779 12.9034 8.97626 12.0485 9.24038 numMergedOcc 0
58 mol 155 unq 1 iso 0 dist 6.23493 7.46303 5.71071 5.86939 9.86313 7.51198 12.2416 11.0769 5.50031 9.80845 9.16779 12.9034 8.97626 4.48516 9.16358 numMergedOcc 0
59 mol 155 unq 2 iso 0 dist 6.23493 7.46303 5.71071 5.86939 9.86313 7.51198 10.9606 10.4923 6.89781 7.55196 9.16779 12.9034 8.97626 4.48516 9.24038 numMergedOcc 0
60 mol 155 unq 3 iso 0 dist 7.46303 6.23493 5.71071 6.3845 9.14392 7.16254 10.9606 6.89781 10.4923 9.0529 9.16779 8.97626 12.9034 12.0485 9.24038 numMergedOcc 0
61 mol 155 unq 4 iso 0 dist 7.46303 6.23493 5.71071 5.86939 7.51198 9.86313 12.2416 5.50031 11.0769 9.80845 9.16779 8.97626 12.9034 4.48516 9.16358 numMergedOcc 0
62 mol 155 unq 5 iso 0 dist 7.46303 6.23493 5.71071 5.86939 7.51198 9.86313 10.9606 6.89781 10.4923 7.55196 9.16779 8.97626 12.9034 4.48516 9.24038 numMergedOcc 0
63 mol 181 unq 0 iso 0 dist 5.98885 9.1374 8.88798 10.0524 7.13543 10.7636 10.6908 5.77299 8.04639 6.32777 11.1802 10.9279 10.0802 5.82396 9.88897 numMergedOcc 0
64 mol 181 unq 1 iso 0 dist 5.98885 9.15386 5.16002 10.0524 7.13543 11.8099 10.6908 5.77299 8.85666 6.32777 11.1802 10.9279 16.0559 5.82396 9.88897 numMergedOcc 0
65 mol 181 unq 2 iso 0 dist 7.81386 7.63312 8.85576 6.7991 4.93785 10.1232 5.94469 7.77758 12.5387 7.05653 5.42158 9.81178 10.6106 5.82984 8.06308 numMergedOcc 0
66 mol 227 unq 0 iso 0 dist 7.22101 9.34734 6.99063 6.43754 8.17891 12.4085 5.41321 10.9607 10.7656 7.57454 5.0317 5.23634 10.7855 4.09934 8.91971 numMergedOcc 0
67 mol 227 unq 1 iso 0 dist 7.22101 8.65997 5.22356 6.43754 8.17891 6.95902 5.41321 10.9607 9.72615 7.57454 5.0317 5.23634 6.91318 4.09934 8.91971 numMergedOcc 0
68 mol 227 unq 2 iso 0 dist 7.22101 7.56888 10.8658 6.43754 8.17891 11.004 5.41321 10.9607 5.10635 7.57454 5.0317 5.23634 11.2661 4.09934 8.91971 numMergedOcc 0
69 mol 227 unq 3 iso 0 dist 7.22101 7.55216 12.4689 6.43754 8.17891 12.8864 5.41321 10.9607 6.48027 7.57454 5.0317 5.23634 12.3663 4.09934 8.91971 numMergedOcc 0
70 mol 227 unq 4 iso 0 dist 8.65997 9.34734 7.60506 6.43754 6.95902 12.4085 5.41321 9.72615 10.7656 7.57454 5.0317 6.91318 10.7855 4.09934 8.91971 numMergedOcc 0
71 mol 227 unq 5 iso 0 dist 8.65997 7.22101 5.22356 6.43754 6.95902 8.17891 5.41321 9.72615 10.9607 7.57454 5.0317 6.91318 5.23634 4.09934 8.91971 numMergedOcc 0
72 mol 227 unq 6 iso 0 dist 8.65997 7.56888 9.70012 6.43754 6.95902 11.004 5.41321 9.72615 5.10635 7.57454 5.0317 6.91318 11.2661 4.09934 8.91971 numMergedOcc 0
73 mol 227 unq 7 iso 0 dist 8.65997 7.55216 12.9332 6.43754 6.95902 12.8864 5.41321 9.72615 6.48027 7.57454 5.0317 6.91318 12.3663 4.09934 8.91971 numMergedOcc 0
74 mol 234 unq 0 iso 0 dist 9.45496 6.56247 5.88703 15.9563 9.5707 10.3388 17.6227 10.0059 13.8349 7.43663 12.4252 7.81215 11.6391 11.8229 7.77911 numMergedOcc 0
75 mol 234 unq 1 iso 0 dist 6.7625 9.36357 5.88703 14.4106 9.5707 10.3388 12.6238 10.0059 13.8349 7.43663 5.75498 7.81215 11.6391 11.8229 7.77911 numMergedOcc 0
76 mol 282 unq 0 iso 0 dist 8.04483 8.76532 10.0156 6.3384 6.85028 10.4802 10.6906 7.80785 8.2662 6.8972 10.8482 12.3763 14.1 5.77779 9.38222 numMergedOcc 0
77 mol 282 unq 1 iso 0 dist 8.04483 6.33524 5.39891 6.3384 6.85028 7.32347 10.6906 7.80785 6.6348 6.8972 10.8482 12.3763 12.2771 5.77779 9.38222 numMergedOcc 0
78 mol 282 unq 2 iso 0 dist 6.33524 8.04483 5.39891 6.3384 7.32347 6.85028 10.6906 6.6348 7.80785 6.8972 10.8482 12.2771 12.3763 5.77779 9.38222 numMergedOcc 0
79 mol 282 unq 3 iso 0 dist 6.33524 8.76532 4.66602 6.3384 7.32347 10.4802 10.6906 6.6348 8.2662 6.8972 10.8482 12.2771 14.1 5.77779 9.38222 numMergedOcc 0
