0 mol 16 unq 0 iso 0 dist 7.63133 6.31718 10.8455 8.43054 9.81307 4.65873 5.32694 5.46498 10.9143 11.1513 6.92781 12.5273 5.05803 6.57331 10.7015 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 7.63133 6.31718 10.8455 8.43054 9.81307 4.65873 10.4155 8.71745 16.4009 16.7405 6.92781 12.5273 5.05803 6.57331 16.241 numMergedOcc 0
2 mol 58 unq 0 iso 0 dist 9.4099 6.64012 6.47414 9.08221 8.55984 4.00553 10.6169 9.55426 13.4544 15.6595 7.5247 11.9025 10.3988 9.97769 11.6716 numMergedOcc 0
3 mol 58 unq 1 iso 0 dist 9.4099 6.64012 6.47414 9.08221 8.55984 4.00553 10.6169 9.55426 13.4544 15.6595 10.0658 14.7109 11.221 9.32706 16.6757 numMergedOcc 0
4 mol 60 unq 0 iso 0 dist 6.65595 9.25011 4.73512 7.57295 7.80499 5.6397 6.54743 8.90863 10.0828 7.48086 5.67502 11.1899 12.4656 8.4312 5.00018 numMergedOcc 0
5 mol 60 unq 1 iso 0 dist 6.65595 6.43294 10.6819 7.57295 7.80499 8.62476 6.54743 8.90863 11.5843 7.48086 5.67502 11.1899 8.7531 8.4312 5.00018 numMergedOcc 0
6 mol 60 unq 2 iso 0 dist 6.65595 8.52121 8.93946 7.57295 7.80499 6.55502 6.54743 8.90863 12.4757 7.48086 5.67502 11.1899 11.6311 8.4312 5.00018 numMergedOcc 0
7 mol 60 unq 3 iso 0 dist 6.43294 6.65595 10.6819 7.57295 8.62476 7.80499 10.1562 8.33063 16.4714 12.8147 5.67502 8.7531 11.1899 8.4312 7.29309 numMergedOcc 0
8 mol 60 unq 4 iso 0 dist 6.43294 6.65595 10.6819 7.57295 8.62476 7.80499 10.1562 8.33063 16.4714 12.8147 6.54743 11.5843 8.90863 7.48086 12.2509 numMergedOcc 0
9 mol 60 unq 5 iso 0 dist 6.43294 6.65595 10.6819 7.57295 8.62476 7.80499 5.67502 8.7531 11.1899 8.4312 6.54743 11.5843 8.90863 7.48086 5.00018 numMergedOcc 0
10 mol 60 unq 6 iso 0 dist 6.43294 9.25011 11.3621 7.57295 8.62476 5.6397 10.1562 8.33063 17.3965 12.8147 5.67502 8.7531 12.4656 8.4312 7.29309 numMergedOcc 0
11 mol 60 unq 7 iso 0 dist 6.43294 9.25011 11.3621 7.57295 8.62476 5.6397 10.1562 8.33063 17.3965 12.8147 6.54743 11.5843 10.0828 7.48086 12.2509 numMergedOcc 0
12 mol 60 unq 8 iso 0 dist 6.43294 9.25011 11.3621 7.57295 8.62476 5.6397 5.67502 8.7531 12.4656 8.4312 6.54743 11.5843 10.0828 7.48086 5.00018 numMergedOcc 0
13 mol 60 unq 9 iso 0 dist 6.43294 8.52121 5.51199 7.57295 8.62476 6.55502 10.1562 8.33063 13.1051 12.8147 5.67502 8.7531 11.6311 8.4312 7.29309 numMergedOcc 0
14 mol 60 unq 10 iso 0 dist 6.43294 8.52121 5.51199 7.57295 8.62476 6.55502 10.1562 8.33063 13.1051 12.8147 6.54743 11.5843 12.4757 7.48086 12.2509 numMergedOcc 0
15 mol 60 unq 11 iso 0 dist 6.43294 8.52121 5.51199 7.57295 8.62476 6.55502 5.67502 8.7531 11.6311 8.4312 6.54743 11.5843 12.4757 7.48086 5.00018 numMergedOcc 0
16 mol 72 unq 0 iso 0 dist 9.96708 8.8178 10.7394 7.12321 7.47371 4.27726 8.24309 9.78528 9.84449 6.21799 5.36766 10.8086 12.8385 9.74228 7.04035 numMergedOcc 0
17 mol 73 unq 0 iso 0 dist 9.96396 9.38498 15.7123 9.73086 5.70116 17.4121 14.9342 8.70481 20.257 12.8207 5.4148 6.19304 10.2049 7.4369 13.3558 numMergedOcc 0
18 mol 73 unq 1 iso 0 dist 9.96396 9.75218 12.016 9.73086 5.70116 14.844 14.9342 8.70481 10.1207 12.8207 5.4148 6.19304 11.6369 7.4369 13.3558 numMergedOcc 0
19 mol 95 unq 0 iso 0 dist 8.03644 9.03572 16.6055 8.27883 15.6249 4.99174 8.41707 7.27724 16.9836 15.6447 6.59884 11.3446 11.5113 7.7152 9.94566 numMergedOcc 0
20 mol 95 unq 1 iso 0 dist 8.03644 8.83255 13.8105 8.27883 15.6249 8.67311 8.41707 7.27724 16.9811 15.6447 6.59884 11.3446 12.9844 7.7152 9.94566 numMergedOcc 0
21 mol 100 unq 0 iso 0 dist 9.60661 6.65086 5.88134 8.91882 4.03277 6.23008 11.5403 7.17106 10.5134 10.5432 10.8375 10.1489 13.2001 9.21662 10.8586 numMergedOcc 0
22 mol 100 unq 1 iso 0 dist 9.60661 6.65086 5.88134 8.91882 4.03277 6.23008 7.80879 9.35224 6.56369 11.5088 10.8375 10.1489 13.2001 9.21662 15.1999 numMergedOcc 0
23 mol 100 unq 2 iso 0 dist 6.65086 9.60661 5.88134 8.91882 6.23008 4.03277 8.8807 7.47343 12.0662 9.76432 10.8375 13.2001 10.1489 9.21662 16.3949 numMergedOcc 0
24 mol 100 unq 3 iso 0 dist 6.65086 9.60661 5.88134 8.91882 6.23008 4.03277 7.80879 6.56369 9.35224 11.5088 10.8375 13.2001 10.1489 9.21662 15.1999 numMergedOcc 0
25 mol 100 unq 4 iso 0 dist 6.65086 9.60661 5.88134 8.91882 6.23008 4.03277 5.38414 9.30209 10.5853 11.6812 10.8375 13.2001 10.1489 9.21662 11.2306 numMergedOcc 0
26 mol 133 unq 0 iso 0 dist 7.24514 8.22656 6.65743 8.26547 5.03174 4.88025 6.761 9.91388 10.0372 12.4934 5.61668 10.2995 6.82262 9.05342 8.28069 numMergedOcc 0
27 mol 133 unq 1 iso 0 dist 7.24514 8.22656 6.65743 8.26547 5.03174 4.88025 7.6656 9.52634 13.4163 13.5471 5.61668 10.2995 6.82262 9.05342 12.4308 numMergedOcc 0
28 mol 134 unq 0 iso 0 dist 8.94367 9.86662 6.81259 7.21868 8.06642 4.00092 5.49782 6.37586 9.71307 7.93372 5.62899 11.7385 11.3835 9.66543 10.7144 numMergedOcc 0
29 mol 134 unq 1 iso 0 dist 8.94367 9.86662 6.81259 7.21868 8.06642 4.00092 8.80819 6.49416 12.5075 11.988 5.62899 11.7385 11.3835 9.66543 12.8168 numMergedOcc 0
30 mol 134 unq 2 iso 0 dist 8.94367 9.86662 6.81259 7.21868 8.06642 4.00092 8.80819 6.49416 12.5075 11.988 5.49782 6.37586 9.71307 7.93372 5.00817 numMergedOcc 0
31 mol 134 unq 3 iso 0 dist 6.37586 9.71307 6.81259 7.93372 8.06642 4.00092 5.49782 8.94367 9.86662 7.21868 10.7144 11.7385 11.3835 9.66543 5.62899 numMergedOcc 0
32 mol 134 unq 4 iso 0 dist 6.37586 9.71307 6.81259 7.93372 8.06642 4.00092 5.00817 6.49416 12.5075 11.988 10.7144 11.7385 11.3835 9.66543 12.8168 numMergedOcc 0
33 mol 134 unq 5 iso 0 dist 6.37586 9.71307 6.81259 7.93372 8.06642 4.00092 5.00817 6.49416 12.5075 11.988 5.49782 8.94367 9.86662 7.21868 8.80819 numMergedOcc 0
34 mol 134 unq 6 iso 0 dist 6.49416 8.94367 8.80819 9.33094 12.3479 7.41373 5.00526 6.54501 11.9139 11.2896 6.81259 12.5075 9.86662 8.69531 11.3271 numMergedOcc 0
35 mol 134 unq 7 iso 0 dist 6.49416 6.37586 5.00817 9.33094 12.3479 10.8635 5.00526 6.54501 9.5126 11.2896 6.81259 12.5075 9.71307 8.69531 11.3271 numMergedOcc 0
36 mol 134 unq 8 iso 0 dist 9.86662 8.94367 6.81259 7.21868 4.00092 8.06642 5.49782 9.71307 6.37586 7.93372 5.62899 11.3835 11.7385 9.66543 10.7144 numMergedOcc 0
37 mol 134 unq 9 iso 0 dist 9.86662 9.71307 5.49782 9.1998 12.8086 15.0225 6.81259 8.94367 6.37586 11.0808 11.6064 15.281 15.6507 6.42772 10.1584 numMergedOcc 0
38 mol 134 unq 10 iso 0 dist 9.86662 9.71307 5.49782 9.1998 12.8086 15.0225 6.81259 8.94367 6.37586 11.0808 7.09823 14.0375 15.9508 8.70621 13.4122 numMergedOcc 0
39 mol 134 unq 11 iso 0 dist 9.71307 6.37586 6.81259 7.93372 4.00092 8.06642 5.49782 9.86662 8.94367 7.21868 10.7144 11.3835 11.7385 9.66543 5.62899 numMergedOcc 0
40 mol 134 unq 12 iso 0 dist 9.71307 9.86662 5.49782 9.1998 15.0225 12.8086 6.81259 6.37586 8.94367 11.0808 11.6064 15.6507 15.281 6.42772 10.1584 numMergedOcc 0
41 mol 134 unq 13 iso 0 dist 9.71307 9.86662 5.49782 9.1998 15.0225 12.8086 6.81259 6.37586 8.94367 11.0808 7.09823 15.9508 14.0375 8.70621 13.4122 numMergedOcc 0
42 mol 152 unq 0 iso 0 dist 5.87555 6.70283 5.42328 6.70693 4.94983 5.39112 5.49936 8.87437 7.16148 10.4895 7.65448 10.399 8.56324 6.59889 10.6875 numMergedOcc 0
43 mol 152 unq 1 iso 0 dist 5.87555 8.67331 5.54906 6.70693 4.94983 9.67475 5.49936 8.87437 8.05741 10.4895 7.65448 10.399 14.1618 6.59889 10.6875 numMergedOcc 0
44 mol 152 unq 2 iso 0 dist 6.70283 5.87555 5.42328 6.70693 5.39112 4.94983 5.49936 7.16148 8.87437 10.4895 7.65448 8.56324 10.399 6.59889 10.6875 numMergedOcc 0
45 mol 152 unq 3 iso 0 dist 6.70283 8.67331 6.4896 6.70693 5.39112 9.67475 5.49936 7.16148 8.05741 10.4895 7.65448 8.56324 14.1618 6.59889 10.6875 numMergedOcc 0
46 mol 152 unq 4 iso 0 dist 8.67331 5.87555 5.54906 6.70693 9.67475 4.94983 5.49936 8.05741 8.87437 10.4895 7.65448 14.1618 10.399 6.59889 10.6875 numMergedOcc 0
47 mol 152 unq 5 iso 0 dist 8.67331 6.70283 6.4896 6.70693 9.67475 5.39112 5.49936 8.05741 7.16148 10.4895 7.65448 14.1618 8.56324 6.59889 10.6875 numMergedOcc 0
48 mol 181 unq 0 iso 0 dist 9.1374 8.03334 13.2049 9.76212 12.9532 6.50233 8.88798 5.98885 10.7062 13.2783 6.01247 9.94371 10.9639 8.59874 12.6324 numMergedOcc 0
49 mol 181 unq 1 iso 0 dist 9.1374 8.03334 13.2049 9.76212 12.9532 6.50233 12.1628 9.15386 14.9794 18.2853 6.01247 9.94371 10.9639 8.59874 16.5106 numMergedOcc 0
50 mol 224 unq 0 iso 0 dist 6.57273 6.60589 5.0744 8.79428 7.05804 5.76843 4.70378 8.95269 9.99123 13.2325 6.77699 10.103 6.65832 6.99769 10.9861 numMergedOcc 0
51 mol 224 unq 1 iso 0 dist 6.57273 6.60589 5.0744 8.79428 7.05804 5.76843 4.70378 8.95269 9.99123 13.2325 8.49799 5.78342 9.16166 6.8692 11.5372 numMergedOcc 0
52 mol 224 unq 2 iso 0 dist 6.57273 6.60589 5.0744 8.79428 7.05804 5.76843 8.49799 5.78342 9.16166 6.8692 6.77699 10.103 6.65832 6.99769 11.328 numMergedOcc 0
53 mol 224 unq 3 iso 0 dist 6.60589 6.57273 5.0744 8.79428 5.76843 7.05804 6.77699 6.65832 10.103 6.99769 8.49799 9.16166 5.78342 6.8692 11.328 numMergedOcc 0
54 mol 224 unq 4 iso 0 dist 6.60589 6.57273 5.0744 8.79428 5.76843 7.05804 8.49799 9.16166 5.78342 6.8692 6.77699 6.65832 10.103 6.99769 11.328 numMergedOcc 0
55 mol 224 unq 5 iso 0 dist 5.78342 9.16166 5.0744 6.8692 7.05804 5.76843 11.5372 8.95269 9.99123 13.2325 11.328 10.103 6.65832 6.99769 10.9861 numMergedOcc 0
56 mol 224 unq 6 iso 0 dist 5.78342 9.16166 5.0744 6.8692 7.05804 5.76843 11.5372 8.95269 9.99123 13.2325 8.49799 6.57273 6.60589 8.79428 4.70378 numMergedOcc 0
57 mol 224 unq 7 iso 0 dist 5.78342 9.16166 5.0744 6.8692 7.05804 5.76843 8.49799 6.57273 6.60589 8.79428 11.328 10.103 6.65832 6.99769 6.77699 numMergedOcc 0
58 mol 224 unq 8 iso 0 dist 5.78342 5.81334 5.60236 6.8692 7.05804 4.54188 11.5372 8.95269 14.0676 13.2325 11.328 10.103 10.9745 6.99769 10.9861 numMergedOcc 0
59 mol 224 unq 9 iso 0 dist 5.78342 5.81334 5.60236 6.8692 7.05804 4.54188 11.5372 8.95269 14.0676 13.2325 8.49799 6.57273 10.5128 8.79428 4.70378 numMergedOcc 0
60 mol 224 unq 10 iso 0 dist 5.78342 5.81334 5.60236 6.8692 7.05804 4.54188 8.49799 6.57273 10.5128 8.79428 11.328 10.103 10.9745 6.99769 6.77699 numMergedOcc 0
61 mol 224 unq 11 iso 0 dist 9.16166 5.78342 5.0744 6.8692 5.76843 7.05804 11.328 6.65832 10.103 6.99769 8.49799 6.60589 6.57273 8.79428 6.77699 numMergedOcc 0
62 mol 224 unq 12 iso 0 dist 9.16166 5.78342 5.0744 6.8692 5.76843 7.05804 8.49799 6.60589 6.57273 8.79428 11.328 6.65832 10.103 6.99769 6.77699 numMergedOcc 0
63 mol 224 unq 13 iso 0 dist 9.16166 5.81334 6.91102 6.8692 5.76843 4.54188 11.328 6.65832 10.9745 6.99769 8.49799 6.60589 10.5128 8.79428 6.77699 numMergedOcc 0
64 mol 224 unq 14 iso 0 dist 9.16166 5.81334 6.91102 6.8692 5.76843 4.54188 8.49799 6.60589 10.5128 8.79428 11.328 6.65832 10.9745 6.99769 6.77699 numMergedOcc 0
65 mol 227 unq 0 iso 0 dist 7.22101 7.09863 4.39704 5.23634 5.0317 5.83175 6.99063 9.34734 10.4905 10.7855 5.22356 8.65997 10.8157 6.91318 7.60506 numMergedOcc 0
66 mol 227 unq 1 iso 0 dist 7.22101 7.09863 4.39704 5.23634 5.0317 5.83175 10.8658 7.56888 11.0431 11.2661 5.22356 8.65997 10.8157 6.91318 9.70012 numMergedOcc 0
67 mol 227 unq 2 iso 0 dist 7.22101 7.09863 4.39704 5.23634 5.0317 5.83175 12.4689 7.55216 10.0334 12.3663 5.22356 8.65997 10.8157 6.91318 12.9332 numMergedOcc 0
68 mol 229 unq 0 iso 0 dist 7.03423 8.22528 5.57838 7.27993 7.22525 5.70473 6.84129 9.06952 13.2905 11.9869 5.1556 11.9282 11.3979 9.51168 10.4478 numMergedOcc 0
69 mol 229 unq 1 iso 0 dist 7.03423 8.22528 5.57838 7.27993 7.22525 5.70473 6.84129 9.06952 13.2905 11.9869 7.0298 11.4362 11.7165 6.95201 10.2557 numMergedOcc 0
70 mol 234 unq 0 iso 0 dist 9.45496 6.7625 7.82322 7.81215 12.4252 5.75498 5.88703 6.56247 9.36357 11.6391 10.2693 17.458 10.701 5.64285 15.2225 numMergedOcc 0
71 mol 234 unq 1 iso 0 dist 6.7625 9.45496 7.82322 7.81215 5.75498 12.4252 5.88703 9.36357 6.56247 11.6391 10.2693 10.701 17.458 5.64285 15.2225 numMergedOcc 0
72 mol 259 unq 0 iso 0 dist 8.13497 7.88519 4.69778 9.46361 12.2293 11.6988 10.582 8.53687 10.5767 18.7675 6.96053 10.3935 7.46176 6.95511 15.7715 numMergedOcc 0
73 mol 259 unq 1 iso 0 dist 7.88519 8.13497 4.69778 9.46361 11.6988 12.2293 4.86771 7.84554 9.95973 12.8903 6.96053 7.46176 10.3935 6.95511 7.64658 numMergedOcc 0
74 mol 259 unq 2 iso 0 dist 7.88519 8.13497 4.69778 9.46361 11.6988 12.2293 10.4881 9.18903 12.6839 17.104 6.96053 7.46176 10.3935 6.95511 10.5239 numMergedOcc 0
