0 mol 1 unq 0 iso 0 dist 9.00903 9.12196 7.4817 7.94662 6.09918 7.73435 14.3332 5.92202 10.5521 8.26708 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 8.96553 7.3915 7.43529 6.32152 10.715 5.00267 10.5239 6.66612 5.02333 7.8922 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 8.57077 9.78006 3.98483 11.0722 8.83269 5.55437 15.1483 9.76038 6.119 7.05346 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 6.86014 6.60423 6.00575 6.58998 10.7114 9.38831 8.86116 10.0952 5.97304 6.72502 numMergedOcc 0
4 mol 24 unq 1 iso 0 dist 8.86116 6.72502 6.58998 11.2106 13.0257 9.40479 13.2433 11.4989 9.48345 4.93188 numMergedOcc 0
5 mol 24 unq 2 iso 0 dist 8.86116 6.72502 6.58998 11.2106 13.0257 9.40479 15.5296 19.2131 13.1456 9.24958 numMergedOcc 0
6 mol 24 unq 3 iso 0 dist 8.86116 6.72502 6.58998 5.97304 6.60423 9.38831 10.5273 7.05502 11.0493 7.83786 numMergedOcc 0
7 mol 24 unq 4 iso 0 dist 8.38394 6.72502 6.59374 11.2106 15.7639 9.40479 13.2433 15.4364 9.48345 4.93188 numMergedOcc 0
8 mol 24 unq 5 iso 0 dist 8.38394 6.72502 6.59374 11.2106 15.7639 9.40479 15.5296 19.1123 13.1456 9.24958 numMergedOcc 0
9 mol 24 unq 6 iso 0 dist 8.38394 6.72502 6.59374 5.97304 9.0934 9.38831 8.86116 6.44287 6.58998 6.60423 numMergedOcc 0
10 mol 24 unq 7 iso 0 dist 8.38394 6.72502 6.59374 5.97304 9.0934 9.38831 10.5273 5.79707 11.0493 7.83786 numMergedOcc 0
11 mol 24 unq 8 iso 0 dist 5.54419 4.93188 4.33963 9.48345 11.2485 9.40479 13.2433 14.6259 11.2106 6.72502 numMergedOcc 0
12 mol 24 unq 9 iso 0 dist 7.36323 9.24958 4.33963 13.1456 11.2485 9.40479 15.5296 14.6259 11.2106 6.72502 numMergedOcc 0
13 mol 43 unq 0 iso 0 dist 5.73819 8.44903 5.48048 5.64171 8.60739 7.31982 10.5523 8.13395 7.05402 9.93832 numMergedOcc 0
14 mol 43 unq 1 iso 0 dist 8.80331 9.93832 9.06158 7.05402 10.0649 7.31982 10.5523 5.06502 5.64171 8.44903 numMergedOcc 0
15 mol 43 unq 2 iso 0 dist 6.20293 8.60739 9.06158 5.48048 10.0649 7.31982 5.73819 5.06502 5.64171 8.44903 numMergedOcc 0
16 mol 43 unq 3 iso 0 dist 8.93915 8.60739 11.3891 5.48048 13.5072 7.31982 5.73819 5.89973 5.64171 8.44903 numMergedOcc 0
17 mol 115 unq 0 iso 0 dist 7.30858 5.72642 5.61704 7.21418 10.0289 8.71286 7.88312 11.5723 7.3094 5.74857 numMergedOcc 0
18 mol 115 unq 1 iso 0 dist 5.83991 5.72642 6.4497 7.21418 10.9766 8.71286 7.88312 8.02349 7.3094 5.74857 numMergedOcc 0
19 mol 115 unq 2 iso 0 dist 6.11741 5.74857 6.08806 7.3094 10.9734 8.71286 7.88312 7.69052 7.21418 5.72642 numMergedOcc 0
20 mol 119 unq 0 iso 0 dist 8.73993 7.77116 3.78311 4.91132 8.56342 8.03035 10.3704 4.85907 4.99056 7.99857 numMergedOcc 0
21 mol 119 unq 1 iso 0 dist 9.87172 7.99857 7.61939 4.99056 13.1741 8.03035 10.3704 12.4603 4.91132 7.77116 numMergedOcc 0
22 mol 152 unq 0 iso 0 dist 5.87555 8.35555 5.59336 5.70788 8.28642 6.39031 10.399 7.65448 7.2238 9.77552 numMergedOcc 0
23 mol 152 unq 1 iso 0 dist 8.87437 8.35555 10.9728 5.70788 13.1536 6.39031 10.399 10.6875 7.2238 9.77552 numMergedOcc 0
24 mol 152 unq 2 iso 0 dist 8.87437 8.35555 10.9728 5.70788 13.1536 6.39031 5.87555 5.49936 5.59336 8.28642 numMergedOcc 0
25 mol 152 unq 3 iso 0 dist 8.56324 9.77552 9.35627 7.2238 10.4911 6.39031 10.399 5.42328 5.70788 8.35555 numMergedOcc 0
26 mol 152 unq 4 iso 0 dist 6.70283 8.28642 9.35627 5.59336 10.4911 6.39031 5.87555 5.42328 5.70788 8.35555 numMergedOcc 0
27 mol 152 unq 5 iso 0 dist 8.67331 8.28642 11.2078 5.59336 13.0858 6.39031 5.87555 5.54906 5.70788 8.35555 numMergedOcc 0
28 mol 156 unq 0 iso 0 dist 8.34702 7.73169 5.71107 5.82636 6.2319 4.9941 13.584 7.14831 10.7975 9.31851 numMergedOcc 0
29 mol 156 unq 1 iso 0 dist 8.34702 7.73169 5.71107 5.82636 6.2319 4.9941 9.06726 6.31306 11.2067 9.97732 numMergedOcc 0
30 mol 156 unq 2 iso 0 dist 8.34702 5.38091 10.7023 5.82636 6.2319 8.06913 13.584 7.14831 13.6634 9.31851 numMergedOcc 0
31 mol 156 unq 3 iso 0 dist 8.34702 5.38091 10.7023 5.82636 6.2319 8.06913 9.06726 6.31306 9.00862 9.97732 numMergedOcc 0
32 mol 156 unq 4 iso 0 dist 9.06726 7.73169 11.2067 5.82636 9.97732 4.9941 13.584 9.98789 10.7975 9.31851 numMergedOcc 0
33 mol 156 unq 5 iso 0 dist 9.06726 7.73169 11.2067 5.82636 9.97732 4.9941 8.34702 6.31306 5.71107 6.2319 numMergedOcc 0
34 mol 156 unq 6 iso 0 dist 9.06726 5.38091 9.00862 6.44255 11.1392 5.90883 8.34702 6.31306 10.7023 9.43259 numMergedOcc 0
35 mol 156 unq 7 iso 0 dist 9.06726 5.38091 9.00862 5.82636 9.97732 8.06913 13.584 9.98789 13.6634 9.31851 numMergedOcc 0
36 mol 156 unq 8 iso 0 dist 9.06726 5.38091 9.00862 5.82636 9.97732 8.06913 8.34702 6.31306 10.7023 6.2319 numMergedOcc 0
37 mol 156 unq 9 iso 0 dist 8.33171 7.73169 9.44399 5.82636 10.5243 4.9941 13.584 13.0839 10.7975 9.31851 numMergedOcc 0
38 mol 156 unq 10 iso 0 dist 8.33171 7.73169 9.44399 5.82636 10.5243 4.9941 8.34702 6.56229 5.71107 6.2319 numMergedOcc 0
39 mol 156 unq 11 iso 0 dist 8.33171 7.73169 9.44399 5.82636 10.5243 4.9941 9.06726 5.64555 11.2067 9.97732 numMergedOcc 0
40 mol 156 unq 12 iso 0 dist 8.33171 5.38091 11.1271 6.44255 12.8935 5.90883 8.34702 6.56229 10.7023 9.43259 numMergedOcc 0
41 mol 156 unq 13 iso 0 dist 8.33171 5.38091 11.1271 5.82636 10.5243 8.06913 13.584 13.0839 13.6634 9.31851 numMergedOcc 0
42 mol 156 unq 14 iso 0 dist 8.33171 5.38091 11.1271 5.82636 10.5243 8.06913 8.34702 6.56229 10.7023 6.2319 numMergedOcc 0
43 mol 156 unq 15 iso 0 dist 8.33171 5.38091 11.1271 5.82636 10.5243 8.06913 9.06726 5.64555 9.00862 9.97732 numMergedOcc 0
44 mol 186 unq 0 iso 0 dist 7.54065 7.20574 8.90184 12.7155 15.9107 7.55358 16.1971 16.4637 9.27818 9.56197 numMergedOcc 0
45 mol 186 unq 1 iso 0 dist 7.54065 7.20574 8.90184 12.7155 15.9107 7.55358 18.5854 21.886 13.0197 7.24795 numMergedOcc 0
46 mol 186 unq 2 iso 0 dist 7.54065 7.20574 8.90184 12.7155 15.9107 7.55358 10.7914 9.50685 4.37002 8.64409 numMergedOcc 0
47 mol 186 unq 3 iso 0 dist 7.54065 7.20574 8.90184 12.7155 15.9107 7.55358 16.7729 16.6762 9.72941 7.60202 numMergedOcc 0
48 mol 186 unq 4 iso 0 dist 8.87694 6.85302 8.90184 9.97575 15.9107 7.55358 15.6447 16.4637 9.27818 9.56197 numMergedOcc 0
49 mol 186 unq 5 iso 0 dist 8.87694 6.85302 8.90184 9.97575 15.9107 7.55358 16.9992 21.886 13.0197 7.24795 numMergedOcc 0
50 mol 186 unq 6 iso 0 dist 8.87694 6.85302 8.90184 9.97575 15.9107 7.55358 9.09754 9.50685 4.37002 8.64409 numMergedOcc 0
51 mol 186 unq 7 iso 0 dist 8.87694 6.85302 8.90184 9.97575 15.9107 7.55358 14.1487 16.6762 9.72941 7.60202 numMergedOcc 0
52 mol 186 unq 8 iso 0 dist 8.87694 9.98215 12.8303 9.97575 15.9107 7.60991 15.6447 16.4637 9.55926 9.56197 numMergedOcc 0
53 mol 186 unq 9 iso 0 dist 8.87694 9.98215 12.8303 9.97575 15.9107 7.60991 16.9992 21.886 12.9082 7.24795 numMergedOcc 0
54 mol 186 unq 10 iso 0 dist 8.87694 9.98215 12.8303 9.97575 15.9107 7.60991 9.09754 9.50685 4.64235 8.64409 numMergedOcc 0
55 mol 186 unq 11 iso 0 dist 8.87694 9.98215 12.8303 9.97575 15.9107 7.60991 14.1487 16.6762 5.39885 7.60202 numMergedOcc 0
56 mol 186 unq 12 iso 0 dist 9.09754 8.64409 9.97575 4.37002 6.85302 7.55358 10.7914 5.74635 12.7155 7.20574 numMergedOcc 0
57 mol 186 unq 13 iso 0 dist 9.09754 6.85302 4.37002 9.97575 8.64409 7.55358 15.6447 8.04815 9.27818 9.56197 numMergedOcc 0
58 mol 186 unq 14 iso 0 dist 9.09754 6.85302 4.37002 9.97575 8.64409 7.55358 16.9992 13.684 13.0197 7.24795 numMergedOcc 0
59 mol 186 unq 15 iso 0 dist 9.09754 6.85302 4.37002 9.97575 8.64409 7.55358 14.1487 7.18269 9.72941 7.60202 numMergedOcc 0
60 mol 186 unq 16 iso 0 dist 9.09754 9.98215 4.64235 9.97575 8.64409 7.60991 15.6447 8.04815 9.55926 9.56197 numMergedOcc 0
61 mol 186 unq 17 iso 0 dist 9.09754 9.98215 4.64235 9.97575 8.64409 7.60991 16.9992 13.684 12.9082 7.24795 numMergedOcc 0
62 mol 186 unq 18 iso 0 dist 9.09754 9.98215 4.64235 9.97575 8.64409 7.60991 14.1487 7.18269 5.39885 7.60202 numMergedOcc 0
63 mol 227 unq 0 iso 0 dist 9.34734 8.03442 10.2525 11.0628 12.9778 9.56257 7.22101 6.99063 10.5813 8.38865 numMergedOcc 0
64 mol 227 unq 1 iso 0 dist 9.34734 8.03442 10.2525 11.0628 12.9778 9.56257 8.65997 7.60506 7.22396 5.4694 numMergedOcc 0
65 mol 227 unq 2 iso 0 dist 7.22101 8.03442 10.5813 11.0628 8.38865 9.56257 8.65997 5.22356 7.22396 5.4694 numMergedOcc 0
66 mol 227 unq 3 iso 0 dist 8.65997 8.03442 7.22396 11.0628 5.4694 9.56257 7.22101 5.22356 10.5813 8.38865 numMergedOcc 0
67 mol 227 unq 4 iso 0 dist 7.56888 8.03442 6.10296 11.0628 13.9676 9.56257 7.22101 10.8658 10.5813 8.38865 numMergedOcc 0
68 mol 227 unq 5 iso 0 dist 7.56888 8.03442 6.10296 11.0628 13.9676 9.56257 8.65997 9.70012 7.22396 5.4694 numMergedOcc 0
69 mol 227 unq 6 iso 0 dist 7.55216 8.03442 9.69537 11.0628 16.9219 9.56257 7.22101 12.4689 10.5813 8.38865 numMergedOcc 0
70 mol 227 unq 7 iso 0 dist 7.55216 8.03442 9.69537 11.0628 16.9219 9.56257 8.65997 12.9332 7.22396 5.4694 numMergedOcc 0
71 mol 227 unq 8 iso 0 dist 7.09863 8.38865 12.9587 10.5813 12.2278 9.56257 7.22101 4.39704 11.0628 8.03442 numMergedOcc 0
72 mol 238 unq 0 iso 0 dist 5.72887 7.32982 12.3808 10.7551 11.2809 9.89583 12.2442 10.027 14.1055 5.52379 numMergedOcc 0
73 mol 252 unq 0 iso 0 dist 8.1148 6.53679 11.056 6.28227 12.322 8.55481 10.5136 14.9102 7.63376 6.86945 numMergedOcc 0
74 mol 252 unq 1 iso 0 dist 8.1715 6.53679 5.23748 6.28227 12.2615 8.55481 10.5136 11.7918 7.63376 6.86945 numMergedOcc 0
75 mol 252 unq 2 iso 0 dist 8.33025 7.50201 11.056 5.25252 12.322 8.55481 7.19638 14.9102 7.63376 6.86945 numMergedOcc 0
76 mol 252 unq 3 iso 0 dist 9.2288 7.50201 5.23748 5.25252 12.2615 8.55481 7.19638 11.7918 7.63376 6.86945 numMergedOcc 0
77 mol 252 unq 4 iso 0 dist 7.19638 6.86945 5.25252 7.63376 7.50201 8.55481 10.5136 6.0987 6.28227 6.53679 numMergedOcc 0
78 mol 258 unq 0 iso 0 dist 6.60405 9.53063 6.6525 7.42673 6.70815 6.47194 6.42289 7.26417 5.27959 7.99477 numMergedOcc 0
79 mol 258 unq 1 iso 0 dist 6.42289 9.53063 5.27959 7.42673 7.99477 6.47194 6.60405 7.26417 6.6525 6.70815 numMergedOcc 0
80 mol 264 unq 0 iso 0 dist 9.17653 6.14323 13.0621 9.37297 15.2775 5.74568 9.90113 14.4574 4.48907 7.52281 numMergedOcc 0
81 mol 264 unq 1 iso 0 dist 9.17653 6.14323 13.0621 9.37297 15.2775 5.74568 13.9815 16.6464 10.1591 6.42588 numMergedOcc 0
82 mol 294 unq 0 iso 0 dist 8.15665 9.13907 5.25615 12.0308 12.1586 7.41079 14.9913 10.7815 6.21267 7.91611 numMergedOcc 0
