0 mol 9 unq 0 iso 0 dist 8.57077 9.62394 9.5997 11.0722 8.83269 8.076 15.1483 9.76038 8.50424 7.05346 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 8.57077 9.62394 9.5997 14.814 15.5119 6.32226 14.896 11.5235 6.02809 7.9944 numMergedOcc 0
2 mol 9 unq 2 iso 0 dist 8.57077 9.62394 9.5997 14.814 15.5119 6.32226 13.3648 12.8474 4.98827 7.032 numMergedOcc 0
3 mol 19 unq 0 iso 0 dist 8.4674 6.41575 4.64838 5.18512 10.1882 6.39966 9.78944 7.83352 6.42867 7.48847 numMergedOcc 0
4 mol 19 unq 1 iso 0 dist 8.4674 6.41575 4.64838 5.18512 10.1882 6.39966 4.54938 7.67038 4.97119 6.92532 numMergedOcc 0
5 mol 19 unq 2 iso 0 dist 8.4674 6.41575 4.64838 5.18512 10.1882 6.39966 7.82074 10.3915 6.01808 6.36455 numMergedOcc 0
6 mol 19 unq 3 iso 0 dist 4.54938 6.41575 4.97119 5.18512 6.92532 6.39966 9.78944 10.8007 6.42867 7.48847 numMergedOcc 0
7 mol 19 unq 4 iso 0 dist 4.54938 6.41575 4.97119 5.18512 6.92532 6.39966 7.82074 5.03957 6.01808 6.36455 numMergedOcc 0
8 mol 19 unq 5 iso 0 dist 7.82074 6.41575 6.01808 5.18512 6.36455 6.39966 9.78944 10.6598 6.42867 7.48847 numMergedOcc 0
9 mol 19 unq 6 iso 0 dist 7.82074 6.41575 6.01808 5.18512 6.36455 6.39966 4.54938 5.03957 4.97119 6.92532 numMergedOcc 0
10 mol 19 unq 7 iso 0 dist 4.51865 6.41423 4.64838 9.47529 10.1882 6.39966 9.56313 7.83352 6.42867 7.48847 numMergedOcc 0
11 mol 19 unq 8 iso 0 dist 4.51865 6.41423 4.64838 9.47529 10.1882 6.39966 6.864 7.67038 4.97119 6.92532 numMergedOcc 0
12 mol 19 unq 9 iso 0 dist 4.51865 6.41423 4.64838 9.47529 10.1882 6.39966 11.0366 10.3915 6.01808 6.36455 numMergedOcc 0
13 mol 19 unq 10 iso 0 dist 6.864 6.41423 4.97119 9.47529 6.92532 6.39966 9.56313 10.8007 6.42867 7.48847 numMergedOcc 0
14 mol 19 unq 11 iso 0 dist 6.864 6.41423 4.97119 9.47529 6.92532 6.39966 11.0366 5.03957 6.01808 6.36455 numMergedOcc 0
15 mol 24 unq 0 iso 0 dist 6.86014 7.33768 4.32034 6.00575 6.60423 9.69752 11.573 7.05502 9.6469 7.83786 numMergedOcc 0
16 mol 24 unq 1 iso 0 dist 6.86014 7.29868 8.52463 12.0003 13.0257 4.90592 11.0194 11.4989 5.11617 4.93188 numMergedOcc 0
17 mol 24 unq 2 iso 0 dist 6.86014 7.29868 8.52463 12.0003 13.0257 4.90592 20.3888 19.2131 13.2229 9.24958 numMergedOcc 0
18 mol 24 unq 3 iso 0 dist 6.86014 7.29868 8.52463 6.00575 6.60423 9.36461 11.573 7.05502 14.6654 7.83786 numMergedOcc 0
19 mol 24 unq 4 iso 0 dist 8.86116 8.60554 8.52463 11.2106 13.0257 4.90592 13.2433 11.4989 5.11617 4.93188 numMergedOcc 0
20 mol 24 unq 5 iso 0 dist 8.86116 8.60554 8.52463 11.2106 13.0257 4.90592 15.5296 19.2131 13.2229 9.24958 numMergedOcc 0
21 mol 24 unq 6 iso 0 dist 8.86116 8.60554 8.52463 5.97304 6.60423 9.36461 10.5273 7.05502 14.6654 7.83786 numMergedOcc 0
22 mol 24 unq 7 iso 0 dist 8.86116 9.44691 13.4893 11.2106 13.0257 8.16324 13.2433 11.4989 10.8238 4.93188 numMergedOcc 0
23 mol 24 unq 8 iso 0 dist 8.86116 9.44691 13.4893 11.2106 13.0257 8.16324 15.5296 19.2131 6.7828 9.24958 numMergedOcc 0
24 mol 24 unq 9 iso 0 dist 8.38394 8.60554 12.3994 11.2106 15.7639 4.90592 13.2433 15.4364 5.11617 4.93188 numMergedOcc 0
25 mol 24 unq 10 iso 0 dist 8.38394 8.60554 12.3994 11.2106 15.7639 4.90592 15.5296 19.1123 13.2229 9.24958 numMergedOcc 0
26 mol 24 unq 11 iso 0 dist 8.38394 8.60554 12.3994 5.97304 9.0934 9.36461 8.86116 6.44287 8.52463 6.60423 numMergedOcc 0
27 mol 24 unq 12 iso 0 dist 8.38394 8.60554 12.3994 5.97304 9.0934 9.36461 10.5273 5.79707 14.6654 7.83786 numMergedOcc 0
28 mol 24 unq 13 iso 0 dist 8.38394 9.44691 12.505 11.2106 15.7639 8.16324 13.2433 15.4364 10.8238 4.93188 numMergedOcc 0
29 mol 24 unq 14 iso 0 dist 8.38394 9.44691 12.505 11.2106 15.7639 8.16324 15.5296 19.1123 6.7828 9.24958 numMergedOcc 0
30 mol 24 unq 15 iso 0 dist 5.54419 8.4051 5.11617 4.33963 4.93188 4.90592 7.36323 12.3067 13.2229 9.24958 numMergedOcc 0
31 mol 24 unq 16 iso 0 dist 5.54419 8.4051 5.11617 17.4067 14.156 9.36461 15.5324 11.4989 8.52463 6.60423 numMergedOcc 0
32 mol 24 unq 17 iso 0 dist 5.54419 8.4051 5.11617 17.4067 14.156 9.36461 21.7276 18.3227 14.6654 7.83786 numMergedOcc 0
33 mol 24 unq 18 iso 0 dist 5.54419 8.75662 10.8238 4.33963 4.93188 8.16324 7.36323 12.3067 6.7828 9.24958 numMergedOcc 0
34 mol 24 unq 19 iso 0 dist 7.36323 8.4051 13.2229 4.33963 9.24958 4.90592 5.54419 12.3067 5.11617 4.93188 numMergedOcc 0
35 mol 24 unq 20 iso 0 dist 7.36323 8.4051 13.2229 17.4067 20.2475 9.36461 15.5324 19.2131 8.52463 6.60423 numMergedOcc 0
36 mol 24 unq 21 iso 0 dist 7.36323 8.4051 13.2229 17.4067 20.2475 9.36461 21.7276 23.9541 14.6654 7.83786 numMergedOcc 0
37 mol 24 unq 22 iso 0 dist 7.36323 8.75662 6.7828 4.33963 9.24958 8.16324 5.54419 12.3067 10.8238 4.93188 numMergedOcc 0
38 mol 58 unq 0 iso 0 dist 6.86465 8.80614 10.2049 10.4524 14.62 6.62229 10.3224 10.8153 5.85698 7.27383 numMergedOcc 0
39 mol 58 unq 1 iso 0 dist 6.62496 8.80614 9.95364 10.4524 14.6584 6.62229 10.3224 13.1243 5.85698 7.27383 numMergedOcc 0
40 mol 58 unq 2 iso 0 dist 6.35756 8.80614 5.49591 10.4524 10.9864 6.62229 10.3224 8.62958 5.85698 7.27383 numMergedOcc 0
41 mol 73 unq 0 iso 0 dist 9.96396 9.24757 5.11416 8.26458 7.04044 6.48232 6.19304 5.4148 6.56633 8.73253 numMergedOcc 0
42 mol 73 unq 1 iso 0 dist 6.19304 9.24757 6.56633 8.26458 8.73253 6.48232 9.96396 5.4148 5.11416 7.04044 numMergedOcc 0
43 mol 73 unq 2 iso 0 dist 8.70481 9.24757 15.3808 8.26458 10.3244 6.48232 9.96396 14.9342 5.11416 7.04044 numMergedOcc 0
44 mol 73 unq 3 iso 0 dist 8.70481 9.24757 15.3808 8.26458 10.3244 6.48232 6.19304 13.3558 6.56633 8.73253 numMergedOcc 0
45 mol 75 unq 0 iso 0 dist 7.79912 9.81166 11.4997 5.36954 11.1537 7.6433 12.3916 15.4102 5.38908 7.9233 numMergedOcc 0
46 mol 85 unq 0 iso 0 dist 7.97049 9.82915 9.29301 6.37974 7.1589 8.70863 11.3023 4.26409 11.165 8.00777 numMergedOcc 0
47 mol 85 unq 1 iso 0 dist 7.47541 9.82915 13.5116 6.37974 11.2808 8.70863 11.3023 10.7229 11.165 8.00777 numMergedOcc 0
48 mol 85 unq 2 iso 0 dist 7.47541 9.82915 13.5116 6.37974 11.2808 8.70863 7.97049 6.9948 9.29301 7.1589 numMergedOcc 0
49 mol 119 unq 0 iso 0 dist 9.87172 9.11344 10.9441 4.99056 13.1741 8.8562 10.3704 12.4603 7.20179 7.77116 numMergedOcc 0
50 mol 129 unq 0 iso 0 dist 9.61051 6.28565 6.30169 6.67948 15.3413 9.94578 5.83384 9.05135 4.55551 8.03372 numMergedOcc 0
51 mol 130 unq 0 iso 0 dist 9.28393 7.96646 6.73735 14.206 13.2004 9.13191 13.4452 6.50188 8.01932 9.28592 numMergedOcc 0
52 mol 131 unq 0 iso 0 dist 8.40312 9.90168 7.7567 5.89022 8.86329 5.56627 7.12972 5.55373 8.23791 8.71039 numMergedOcc 0
53 mol 131 unq 1 iso 0 dist 8.40312 9.90168 7.7567 9.32969 11.4206 8.50562 14.2958 9.85697 9.60968 9.15431 numMergedOcc 0
54 mol 131 unq 2 iso 0 dist 8.40312 9.90168 7.7567 9.32969 11.4206 8.50562 7.12972 5.55373 8.23791 6.92648 numMergedOcc 0
55 mol 131 unq 3 iso 0 dist 8.40312 9.90168 7.7567 9.32969 11.4206 8.50562 6.85062 10.7062 13.7237 9.29384 numMergedOcc 0
56 mol 131 unq 4 iso 0 dist 7.12972 9.90168 8.23791 5.89022 8.71039 5.56627 8.40312 5.55373 7.7567 8.86329 numMergedOcc 0
57 mol 131 unq 5 iso 0 dist 7.12972 9.90168 8.23791 9.32969 6.92648 8.50562 14.2958 7.58238 9.60968 9.15431 numMergedOcc 0
58 mol 131 unq 6 iso 0 dist 7.12972 9.90168 8.23791 9.32969 6.92648 8.50562 6.85062 6.63273 13.7237 9.29384 numMergedOcc 0
59 mol 131 unq 7 iso 0 dist 6.85062 9.90168 13.7237 5.89022 11.6142 5.56627 8.40312 10.7062 7.7567 8.86329 numMergedOcc 0
60 mol 131 unq 8 iso 0 dist 6.85062 9.90168 13.7237 5.89022 11.6142 5.56627 7.12972 6.63273 8.23791 8.71039 numMergedOcc 0
61 mol 131 unq 9 iso 0 dist 6.85062 9.90168 13.7237 9.32969 9.29384 8.50562 14.2958 13.2572 9.60968 9.15431 numMergedOcc 0
62 mol 131 unq 10 iso 0 dist 6.85062 9.90168 13.7237 9.32969 9.29384 8.50562 7.12972 6.63273 8.23791 6.92648 numMergedOcc 0
63 mol 134 unq 0 iso 0 dist 9.89303 7.69991 4.60632 13.1292 13.6079 9.30061 13.8307 9.51251 7.1797 7.36779 numMergedOcc 0
64 mol 134 unq 1 iso 0 dist 9.89303 7.69991 4.60632 13.1292 13.6079 9.30061 11.9139 6.86927 4.57832 8.20836 numMergedOcc 0
65 mol 134 unq 2 iso 0 dist 6.54501 7.69991 5.71679 13.1292 13.846 9.30061 13.8307 12.8168 7.1797 7.36779 numMergedOcc 0
66 mol 134 unq 3 iso 0 dist 6.54501 7.69991 5.71679 13.1292 13.846 9.30061 11.9139 8.80819 4.57832 8.20836 numMergedOcc 0
67 mol 134 unq 4 iso 0 dist 8.94367 6.23142 4.57832 9.4027 8.20836 9.30061 11.7385 5.62899 7.1797 7.36779 numMergedOcc 0
68 mol 134 unq 5 iso 0 dist 6.37586 6.23142 5.29786 9.4027 10.873 9.30061 11.7385 10.7144 7.1797 7.36779 numMergedOcc 0
69 mol 134 unq 6 iso 0 dist 6.37586 6.23142 5.29786 9.4027 10.873 9.30061 8.94367 5.49782 4.57832 8.20836 numMergedOcc 0
70 mol 134 unq 7 iso 0 dist 6.49416 6.23142 5.71679 9.4027 13.846 9.30061 11.7385 12.8168 7.1797 7.36779 numMergedOcc 0
71 mol 134 unq 8 iso 0 dist 6.49416 6.23142 5.71679 9.4027 13.846 9.30061 8.94367 8.80819 4.57832 8.20836 numMergedOcc 0
72 mol 134 unq 9 iso 0 dist 9.86662 9.94764 4.57832 5.12325 8.20836 9.30061 11.3835 5.62899 7.1797 7.36779 numMergedOcc 0
73 mol 134 unq 10 iso 0 dist 9.71307 9.94764 5.29786 5.12325 10.873 9.30061 11.3835 10.7144 7.1797 7.36779 numMergedOcc 0
74 mol 134 unq 11 iso 0 dist 9.71307 9.94764 5.29786 5.12325 10.873 9.30061 9.86662 5.49782 4.57832 8.20836 numMergedOcc 0
75 mol 175 unq 0 iso 0 dist 6.57069 9.77896 8.29015 11.3554 12.6297 5.89564 18.431 19.6867 11.8693 7.35824 numMergedOcc 0
76 mol 181 unq 0 iso 0 dist 5.98885 9.72611 5.6044 5.93488 6.51749 7.11785 9.09537 10.1912 12.9468 7.20392 numMergedOcc 0
77 mol 181 unq 1 iso 0 dist 9.09537 9.72611 12.9468 5.93488 7.20392 7.11785 5.98885 10.1912 5.6044 6.51749 numMergedOcc 0
78 mol 222 unq 0 iso 0 dist 6.00706 9.07471 7.75466 6.42798 7.862 9.08955 12.6531 10.5806 5.89689 9.2581 numMergedOcc 0
79 mol 222 unq 1 iso 0 dist 6.00706 9.07471 7.75466 6.42798 7.862 9.08955 11.8674 6.9154 10.6944 9.62632 numMergedOcc 0
80 mol 222 unq 2 iso 0 dist 7.54212 9.07471 13.3447 6.42798 12.5287 9.08955 12.6531 17.2569 5.89689 9.2581 numMergedOcc 0
81 mol 222 unq 3 iso 0 dist 7.54212 9.07471 13.3447 6.42798 12.5287 9.08955 11.8674 12.6553 10.6944 9.62632 numMergedOcc 0
82 mol 222 unq 4 iso 0 dist 7.54212 9.07471 13.3447 6.42798 12.5287 9.08955 6.00706 6.8425 7.75466 7.862 numMergedOcc 0
83 mol 239 unq 0 iso 0 dist 7.00034 9.01021 10.0842 5.66732 10.2163 5.0804 13.6473 14.7505 5.05321 8.67805 numMergedOcc 0
