0 mol 16 unq 0 iso 0 dist 6.36377 5.48395 6.31718 12.9591 10.8455 7.63133 10.1011 10.9143 5.32694 5.46498 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 6.36377 5.48395 6.31718 12.9591 10.8455 7.63133 14.8742 16.4009 10.4155 8.71745 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 8.05508 5.34079 6.85766 12.5028 10.0246 7.71095 16.6723 17.79 12.5396 8.84665 numMergedOcc 0
3 mol 59 unq 1 iso 0 dist 8.05508 5.34079 6.85766 12.5028 10.0246 7.71095 11.0021 14.0127 8.19458 8.25513 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 6.18305 4.69583 6.19304 11.0671 5.4148 9.96396 15.7901 10.2049 15.7123 9.38498 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 6.18305 4.69583 6.19304 11.0671 5.4148 9.96396 15.8603 11.6369 12.016 9.75218 numMergedOcc 0
6 mol 85 unq 0 iso 0 dist 6.58793 9.21014 6.19965 10.7244 5.42586 7.97049 7.83419 7.66905 6.9948 7.47541 numMergedOcc 0
7 mol 85 unq 1 iso 0 dist 6.58793 7.83419 7.66905 10.7244 5.42586 7.47541 9.21014 6.19965 6.9948 7.97049 numMergedOcc 0
8 mol 115 unq 0 iso 0 dist 9.35868 8.25001 7.30858 14.0784 10.8507 5.83991 11.4509 13.8473 7.69052 9.33865 numMergedOcc 0
9 mol 115 unq 1 iso 0 dist 9.35868 8.25001 7.30858 13.3494 11.5723 7.88312 11.4509 13.8473 7.69052 6.11741 numMergedOcc 0
10 mol 115 unq 2 iso 0 dist 5.02717 6.75472 5.83991 12.5189 7.69052 9.33865 11.0268 7.88312 8.02349 6.11741 numMergedOcc 0
11 mol 115 unq 3 iso 0 dist 5.02717 11.0268 7.88312 12.5189 7.69052 6.11741 6.75472 5.83991 8.02349 9.33865 numMergedOcc 0
12 mol 115 unq 4 iso 0 dist 4.98864 6.59772 6.11741 12.6493 8.02349 9.33865 10.9437 7.88312 7.69052 5.83991 numMergedOcc 0
13 mol 115 unq 5 iso 0 dist 4.98864 10.9437 7.88312 12.6493 8.02349 5.83991 6.59772 6.11741 7.69052 9.33865 numMergedOcc 0
14 mol 115 unq 6 iso 0 dist 7.95871 4.86477 6.11741 13.7044 8.02349 9.33865 12.0354 7.88312 7.69052 5.83991 numMergedOcc 0
15 mol 115 unq 7 iso 0 dist 7.95871 12.0354 7.88312 13.7044 8.02349 5.83991 4.86477 6.11741 7.69052 9.33865 numMergedOcc 0
16 mol 133 unq 0 iso 0 dist 9.3894 13.0836 9.52634 14.8299 7.6656 7.24514 16.1037 13.4163 6.65743 8.22656 numMergedOcc 0
17 mol 133 unq 1 iso 0 dist 9.50322 5.37072 7.11802 5.82404 8.18495 8.00618 10.2385 13.268 11.965 6.29155 numMergedOcc 0
18 mol 133 unq 2 iso 0 dist 9.50322 5.37072 7.11802 5.82404 8.18495 8.00618 4.64588 12.6651 7.79672 6.80239 numMergedOcc 0
19 mol 134 unq 0 iso 0 dist 9.92932 10.5108 8.94367 9.60411 5.49782 6.37586 6.20443 9.86662 6.81259 9.71307 numMergedOcc 0
20 mol 134 unq 1 iso 0 dist 9.92932 10.5108 8.94367 14.0674 8.80819 6.49416 15.5033 11.9139 5.00526 6.54501 numMergedOcc 0
21 mol 134 unq 2 iso 0 dist 9.92932 6.20443 9.86662 9.60411 5.49782 9.71307 10.5108 8.94367 6.81259 6.37586 numMergedOcc 0
22 mol 134 unq 3 iso 0 dist 9.60411 10.5108 6.37586 9.92932 5.49782 8.94367 6.20443 9.71307 6.81259 9.86662 numMergedOcc 0
23 mol 134 unq 4 iso 0 dist 9.60411 10.5108 6.37586 14.0674 5.00817 6.49416 15.5033 9.5126 5.00526 6.54501 numMergedOcc 0
24 mol 134 unq 5 iso 0 dist 9.60411 6.20443 9.71307 9.92932 5.49782 9.86662 10.5108 6.37586 6.81259 8.94367 numMergedOcc 0
25 mol 134 unq 6 iso 0 dist 9.55556 11.9294 8.94367 12.1043 5.49782 6.37586 6.36794 9.86662 6.81259 9.71307 numMergedOcc 0
26 mol 134 unq 7 iso 0 dist 9.55556 11.9294 8.94367 16.0579 8.80819 6.49416 16.3074 11.9139 5.00526 6.54501 numMergedOcc 0
27 mol 134 unq 8 iso 0 dist 9.55556 6.36794 9.86662 12.1043 5.49782 9.71307 11.9294 8.94367 6.81259 6.37586 numMergedOcc 0
28 mol 152 unq 0 iso 0 dist 8.07256 11.1874 6.70283 13.1529 5.42328 5.87555 8.36099 7.16148 5.49936 8.87437 numMergedOcc 0
29 mol 152 unq 1 iso 0 dist 8.07256 11.1874 6.70283 12.6103 6.4896 8.67331 8.36099 7.16148 5.49936 8.05741 numMergedOcc 0
30 mol 152 unq 2 iso 0 dist 8.07256 8.36099 7.16148 13.1529 5.42328 8.87437 11.1874 6.70283 5.49936 5.87555 numMergedOcc 0
31 mol 152 unq 3 iso 0 dist 8.07256 8.36099 7.16148 12.6103 6.4896 8.05741 11.1874 6.70283 5.49936 8.67331 numMergedOcc 0
32 mol 155 unq 0 iso 0 dist 6.7973 5.01118 6.23493 10.6879 5.71071 7.46303 12.5957 10.2463 7.66392 6.43582 numMergedOcc 0
33 mol 206 unq 0 iso 0 dist 9.36079 13.6173 7.7366 14.4684 5.63422 9.774 20.4169 11.1804 10.4 8.02137 numMergedOcc 0
34 mol 206 unq 1 iso 0 dist 7.42904 9.96254 7.7366 12.7047 5.63422 9.774 17.7981 11.1804 10.4 8.02137 numMergedOcc 0
35 mol 224 unq 0 iso 0 dist 8.39002 5.72088 6.57273 8.46129 5.0744 6.60589 6.31508 10.103 6.77699 6.65832 numMergedOcc 0
36 mol 224 unq 1 iso 0 dist 8.39002 5.72088 6.57273 8.46129 5.0744 6.60589 6.51315 5.78342 8.49799 9.16166 numMergedOcc 0
37 mol 224 unq 2 iso 0 dist 8.39002 6.51315 5.78342 8.46129 5.0744 9.16166 6.31508 10.103 11.328 6.65832 numMergedOcc 0
38 mol 224 unq 3 iso 0 dist 8.39002 6.51315 5.78342 8.46129 5.0744 9.16166 5.72088 6.57273 8.49799 6.60589 numMergedOcc 0
39 mol 224 unq 4 iso 0 dist 8.46129 5.72088 6.60589 8.39002 5.0744 6.57273 9.98893 9.99123 4.70378 8.95269 numMergedOcc 0
40 mol 224 unq 5 iso 0 dist 8.46129 5.72088 6.60589 8.39002 5.0744 6.57273 6.51315 9.16166 8.49799 5.78342 numMergedOcc 0
41 mol 224 unq 6 iso 0 dist 8.46129 6.51315 9.16166 8.39002 5.0744 5.78342 9.98893 9.99123 11.5372 8.95269 numMergedOcc 0
42 mol 224 unq 7 iso 0 dist 8.46129 6.51315 9.16166 8.39002 5.0744 5.78342 5.72088 6.60589 8.49799 6.57273 numMergedOcc 0
43 mol 224 unq 8 iso 0 dist 9.2053 6.51315 5.81334 8.39002 5.60236 5.78342 9.98893 14.0676 11.5372 8.95269 numMergedOcc 0
44 mol 224 unq 9 iso 0 dist 9.2053 6.51315 5.81334 8.39002 5.60236 5.78342 5.72088 10.5128 8.49799 6.57273 numMergedOcc 0
45 mol 224 unq 10 iso 0 dist 9.2053 6.51315 5.81334 8.46129 6.91102 9.16166 6.31508 10.9745 11.328 6.65832 numMergedOcc 0
46 mol 224 unq 11 iso 0 dist 9.2053 6.51315 5.81334 8.46129 6.91102 9.16166 5.72088 10.5128 8.49799 6.60589 numMergedOcc 0
47 mol 227 unq 0 iso 0 dist 9.07872 9.9474 7.09863 11.3366 4.39704 7.22101 8.65229 10.4905 6.99063 9.34734 numMergedOcc 0
48 mol 227 unq 1 iso 0 dist 9.07872 9.9474 7.09863 11.3366 4.39704 7.22101 14.0536 10.8157 5.22356 8.65997 numMergedOcc 0
49 mol 227 unq 2 iso 0 dist 9.07872 9.9474 7.09863 11.3366 4.39704 7.22101 13.0161 11.0431 10.8658 7.56888 numMergedOcc 0
50 mol 227 unq 3 iso 0 dist 9.07872 9.9474 7.09863 11.3366 4.39704 7.22101 11.8065 10.0334 12.4689 7.55216 numMergedOcc 0
51 mol 234 unq 0 iso 0 dist 7.86368 12.0816 9.45496 12.3151 5.88703 6.56247 17.6539 12.9605 6.29886 8.34494 numMergedOcc 0
52 mol 234 unq 1 iso 0 dist 7.86368 12.0816 9.45496 12.3151 5.88703 6.56247 6.94762 6.7625 7.82322 9.36357 numMergedOcc 0
53 mol 234 unq 2 iso 0 dist 7.86368 6.94762 6.7625 12.3151 5.88703 9.36357 17.6539 12.9605 12.1694 8.34494 numMergedOcc 0
54 mol 234 unq 3 iso 0 dist 7.86368 6.94762 6.7625 12.3151 5.88703 9.36357 12.0816 9.45496 7.82322 6.56247 numMergedOcc 0
55 mol 236 unq 0 iso 0 dist 9.89665 4.38595 6.84306 11.3361 5.79505 8.03456 11.247 7.68742 7.28249 9.81562 numMergedOcc 0
56 mol 236 unq 1 iso 0 dist 9.89665 4.38595 6.84306 14.0991 11.3368 9.99038 11.247 7.68742 7.28249 6.27581 numMergedOcc 0
57 mol 236 unq 2 iso 0 dist 9.89665 4.38595 6.84306 9.05929 14.7998 8.35971 4.32403 13.5269 7.43758 8.04248 numMergedOcc 0
58 mol 236 unq 3 iso 0 dist 9.89665 11.247 7.68742 11.3361 5.79505 9.81562 4.38595 6.84306 7.28249 8.03456 numMergedOcc 0
59 mol 236 unq 4 iso 0 dist 9.89665 11.247 7.68742 14.0991 11.3368 6.27581 4.38595 6.84306 7.28249 9.99038 numMergedOcc 0
60 mol 236 unq 5 iso 0 dist 9.05929 4.38595 8.35971 11.3361 14.2337 8.03456 11.247 11.2141 7.28249 9.81562 numMergedOcc 0
61 mol 236 unq 6 iso 0 dist 9.05929 4.38595 8.35971 9.89665 14.7998 6.84306 11.247 11.2141 7.28249 7.68742 numMergedOcc 0
62 mol 236 unq 7 iso 0 dist 9.05929 4.38595 8.35971 14.0991 10.7497 9.99038 11.247 11.2141 7.28249 6.27581 numMergedOcc 0
63 mol 236 unq 8 iso 0 dist 8.90987 5.26654 8.03456 11.2664 7.28249 9.81562 3.82437 6.84306 5.79505 7.68742 numMergedOcc 0
64 mol 236 unq 9 iso 0 dist 8.90987 5.26654 8.03456 11.2664 7.28249 9.81562 13.8124 9.99038 9.90963 6.27581 numMergedOcc 0
65 mol 236 unq 10 iso 0 dist 8.90987 3.82437 6.84306 11.2664 7.28249 7.68742 5.26654 8.03456 5.79505 9.81562 numMergedOcc 0
66 mol 236 unq 11 iso 0 dist 8.90987 3.82437 6.84306 11.2664 7.28249 7.68742 13.8124 9.99038 11.3368 6.27581 numMergedOcc 0
67 mol 236 unq 12 iso 0 dist 8.90987 13.8124 9.99038 11.2664 7.28249 6.27581 5.26654 8.03456 9.90963 9.81562 numMergedOcc 0
68 mol 236 unq 13 iso 0 dist 8.90987 13.8124 9.99038 11.2664 7.28249 6.27581 3.82437 6.84306 11.3368 7.68742 numMergedOcc 0
69 mol 236 unq 14 iso 0 dist 5.66569 11.2013 9.99038 12.3675 9.90963 8.03456 4.15973 6.27581 7.28249 9.81562 numMergedOcc 0
70 mol 236 unq 15 iso 0 dist 5.66569 11.2013 9.99038 11.0771 11.3368 6.84306 4.15973 6.27581 7.28249 7.68742 numMergedOcc 0
71 mol 236 unq 16 iso 0 dist 5.66569 11.2013 9.99038 13.3367 10.7497 8.35971 16.4752 15.7308 7.43758 8.04248 numMergedOcc 0
72 mol 236 unq 17 iso 0 dist 5.66569 4.15973 6.27581 12.3675 9.90963 9.81562 11.2013 9.99038 7.28249 8.03456 numMergedOcc 0
73 mol 236 unq 18 iso 0 dist 5.66569 4.15973 6.27581 11.0771 11.3368 7.68742 11.2013 9.99038 7.28249 6.84306 numMergedOcc 0
74 mol 236 unq 19 iso 0 dist 6.11137 15.1664 9.99038 14.8917 9.90963 8.03456 9.01197 6.27581 7.28249 9.81562 numMergedOcc 0
75 mol 236 unq 20 iso 0 dist 6.11137 15.1664 9.99038 15.2525 11.3368 6.84306 9.01197 6.27581 7.28249 7.68742 numMergedOcc 0
76 mol 236 unq 21 iso 0 dist 6.11137 15.1664 9.99038 15.4718 10.7497 8.35971 20.4221 15.7308 7.43758 8.04248 numMergedOcc 0
77 mol 236 unq 22 iso 0 dist 6.11137 9.01197 6.27581 14.8917 9.90963 9.81562 15.1664 9.99038 7.28249 8.03456 numMergedOcc 0
78 mol 236 unq 23 iso 0 dist 6.11137 9.01197 6.27581 15.2525 11.3368 7.68742 15.1664 9.99038 7.28249 6.84306 numMergedOcc 0
79 mol 253 unq 0 iso 0 dist 8.91612 5.11865 6.73034 12.868 8.02948 8.31064 11.9866 11.6434 7.25988 7.32223 numMergedOcc 0
80 mol 259 unq 0 iso 0 dist 5.90645 10.4985 8.13497 9.73107 4.69778 7.88519 12.0753 9.95973 4.86771 7.84554 numMergedOcc 0
81 mol 259 unq 1 iso 0 dist 5.90645 10.4985 8.13497 9.73107 4.69778 7.88519 15.2324 10.3935 6.96053 7.46176 numMergedOcc 0
82 mol 259 unq 2 iso 0 dist 5.90645 10.4985 8.13497 9.73107 4.69778 7.88519 14.9117 12.6839 10.4881 9.18903 numMergedOcc 0
83 mol 259 unq 3 iso 0 dist 9.54857 15.3806 7.46176 14.0139 6.96053 7.88519 16.7125 10.3935 4.69778 8.13497 numMergedOcc 0
84 mol 272 unq 0 iso 0 dist 9.96394 11.5918 8.33638 13.3211 5.40809 8.46116 15.6097 13.2494 8.12676 9.97651 numMergedOcc 0
