0 mol 7 unq 0 iso 0 dist 6.66645 12.1978 5.72491 4.78012 7.88043 12.2041 10.84 9.55056 10.789 12.2708 numMergedOcc 0
1 mol 7 unq 0 iso 1 dist 6.66645 4.78012 7.88043 12.1978 5.72491 12.2041 10.84 9.55056 12.2708 10.789 numMergedOcc 0
2 mol 7 unq 1 iso 0 dist 6.66645 12.1978 5.72491 4.78012 7.88043 12.2041 6.58295 7.45262 10.515 6.06176 numMergedOcc 0
3 mol 7 unq 1 iso 1 dist 6.66645 4.78012 7.88043 12.1978 5.72491 12.2041 6.58295 7.45262 6.06176 10.515 numMergedOcc 0
4 mol 8 unq 0 iso 0 dist 7.70793 14.4127 6.82379 12.428 6.24978 6.94408 7.55301 8.94096 13.7792 10.6893 numMergedOcc 0
5 mol 8 unq 0 iso 1 dist 7.70793 12.428 6.24978 14.4127 6.82379 6.94408 7.55301 8.94096 10.6893 13.7792 numMergedOcc 0
6 mol 8 unq 1 iso 0 dist 7.70793 14.4127 6.82379 12.428 6.24978 6.94408 5.95206 9.07858 15.4959 12.0818 numMergedOcc 0
7 mol 8 unq 1 iso 1 dist 7.70793 12.428 6.24978 14.4127 6.82379 6.94408 5.95206 9.07858 12.0818 15.4959 numMergedOcc 0
8 mol 8 unq 2 iso 0 dist 7.70793 14.4127 6.82379 14.2248 9.66439 11.2508 7.55301 8.94096 13.7792 13.8882 numMergedOcc 0
9 mol 8 unq 2 iso 1 dist 7.70793 14.2248 9.66439 14.4127 6.82379 11.2508 7.55301 8.94096 13.8882 13.7792 numMergedOcc 0
10 mol 8 unq 3 iso 0 dist 7.70793 14.4127 6.82379 14.2248 9.66439 11.2508 5.95206 9.07858 15.4959 11.4738 numMergedOcc 0
11 mol 8 unq 3 iso 1 dist 7.70793 14.2248 9.66439 14.4127 6.82379 11.2508 5.95206 9.07858 11.4738 15.4959 numMergedOcc 0
12 mol 8 unq 4 iso 0 dist 7.70793 14.4127 6.82379 8.93161 7.3915 12.4076 7.55301 8.94096 13.7792 12.8924 numMergedOcc 0
13 mol 8 unq 4 iso 1 dist 7.70793 8.93161 7.3915 14.4127 6.82379 12.4076 7.55301 8.94096 12.8924 13.7792 numMergedOcc 0
14 mol 8 unq 5 iso 0 dist 7.70793 14.4127 6.82379 8.93161 7.3915 12.4076 5.95206 9.07858 15.4959 4.85329 numMergedOcc 0
15 mol 8 unq 5 iso 1 dist 7.70793 8.93161 7.3915 14.4127 6.82379 12.4076 5.95206 9.07858 4.85329 15.4959 numMergedOcc 0
16 mol 8 unq 2 iso 0 dist 7.70793 12.428 6.24978 14.2248 9.66439 5.3787 7.55301 8.94096 10.6893 13.8882 numMergedOcc 0
17 mol 8 unq 2 iso 1 dist 7.70793 14.2248 9.66439 12.428 6.24978 5.3787 7.55301 8.94096 13.8882 10.6893 numMergedOcc 0
18 mol 8 unq 3 iso 0 dist 7.70793 12.428 6.24978 14.2248 9.66439 5.3787 5.95206 9.07858 12.0818 11.4738 numMergedOcc 0
19 mol 8 unq 3 iso 1 dist 7.70793 14.2248 9.66439 12.428 6.24978 5.3787 5.95206 9.07858 11.4738 12.0818 numMergedOcc 0
20 mol 8 unq 4 iso 0 dist 7.70793 12.428 6.24978 8.93161 7.3915 9.22548 7.55301 8.94096 10.6893 12.8924 numMergedOcc 0
21 mol 8 unq 4 iso 1 dist 7.70793 8.93161 7.3915 12.428 6.24978 9.22548 7.55301 8.94096 12.8924 10.6893 numMergedOcc 0
22 mol 8 unq 5 iso 0 dist 7.70793 12.428 6.24978 8.93161 7.3915 9.22548 5.95206 9.07858 12.0818 4.85329 numMergedOcc 0
23 mol 8 unq 5 iso 1 dist 7.70793 8.93161 7.3915 12.428 6.24978 9.22548 5.95206 9.07858 4.85329 12.0818 numMergedOcc 0
24 mol 8 unq 4 iso 0 dist 7.70793 14.2248 9.66439 8.93161 7.3915 7.96511 7.55301 8.94096 13.8882 12.8924 numMergedOcc 0
25 mol 8 unq 4 iso 1 dist 7.70793 8.93161 7.3915 14.2248 9.66439 7.96511 7.55301 8.94096 12.8924 13.8882 numMergedOcc 0
26 mol 8 unq 5 iso 0 dist 7.70793 14.2248 9.66439 8.93161 7.3915 7.96511 5.95206 9.07858 11.4738 4.85329 numMergedOcc 0
27 mol 8 unq 5 iso 1 dist 7.70793 8.93161 7.3915 14.2248 9.66439 7.96511 5.95206 9.07858 4.85329 11.4738 numMergedOcc 0
28 mol 13 unq 0 iso 0 dist 7.56303 7.01217 5.78148 7.16388 6.26071 5.94592 10.6468 8.00865 13.1699 10.5634 numMergedOcc 0
29 mol 13 unq 0 iso 1 dist 7.56303 7.16388 6.26071 7.01217 5.78148 5.94592 10.6468 8.00865 10.5634 13.1699 numMergedOcc 0
30 mol 13 unq 1 iso 0 dist 7.56303 7.01217 5.78148 7.16388 6.26071 5.94592 6.28453 9.11447 11.1987 12.0488 numMergedOcc 0
31 mol 13 unq 1 iso 1 dist 7.56303 7.16388 6.26071 7.01217 5.78148 5.94592 6.28453 9.11447 12.0488 11.1987 numMergedOcc 0
32 mol 13 unq 2 iso 0 dist 7.56303 7.01217 5.78148 10.9053 8.43325 10.8906 10.6468 8.00865 13.1699 8.66829 numMergedOcc 0
33 mol 13 unq 2 iso 1 dist 7.56303 10.9053 8.43325 7.01217 5.78148 10.8906 10.6468 8.00865 8.66829 13.1699 numMergedOcc 0
34 mol 13 unq 3 iso 0 dist 7.56303 7.01217 5.78148 10.9053 8.43325 10.8906 6.28453 9.11447 11.1987 14.2112 numMergedOcc 0
35 mol 13 unq 3 iso 1 dist 7.56303 10.9053 8.43325 7.01217 5.78148 10.8906 6.28453 9.11447 14.2112 11.1987 numMergedOcc 0
36 mol 13 unq 2 iso 0 dist 7.56303 7.16388 6.26071 10.9053 8.43325 5.43688 10.6468 8.00865 10.5634 8.66829 numMergedOcc 0
37 mol 13 unq 2 iso 1 dist 7.56303 10.9053 8.43325 7.16388 6.26071 5.43688 10.6468 8.00865 8.66829 10.5634 numMergedOcc 0
38 mol 13 unq 3 iso 0 dist 7.56303 7.16388 6.26071 10.9053 8.43325 5.43688 6.28453 9.11447 12.0488 14.2112 numMergedOcc 0
39 mol 13 unq 3 iso 1 dist 7.56303 10.9053 8.43325 7.16388 6.26071 5.43688 6.28453 9.11447 14.2112 12.0488 numMergedOcc 0
40 mol 112 unq 0 iso 0 dist 9.67948 11.4909 6.43433 13.1737 9.92283 5.0812 5.32838 7.82011 6.72991 8.57646 numMergedOcc 0
41 mol 112 unq 0 iso 1 dist 9.67948 13.1737 9.92283 11.4909 6.43433 5.0812 5.32838 7.82011 8.57646 6.72991 numMergedOcc 0
42 mol 112 unq 1 iso 0 dist 6.55773 10.3209 6.43433 13.9635 9.92283 5.0812 7.06309 7.82011 6.72991 8.57646 numMergedOcc 0
43 mol 112 unq 1 iso 1 dist 6.55773 13.9635 9.92283 10.3209 6.43433 5.0812 7.06309 7.82011 8.57646 6.72991 numMergedOcc 0
44 mol 119 unq 0 iso 0 dist 9.2746 6.63018 7.99857 9.23197 8.56342 4.85907 11.3281 9.87025 6.35763 10.0197 numMergedOcc 0
45 mol 119 unq 0 iso 1 dist 9.2746 9.23197 8.56342 6.63018 7.99857 4.85907 11.3281 9.87025 10.0197 6.35763 numMergedOcc 0
46 mol 119 unq 1 iso 0 dist 9.2746 6.63018 7.99857 9.23197 8.56342 4.85907 6.21945 5.85818 7.36192 10.6679 numMergedOcc 0
47 mol 119 unq 1 iso 1 dist 9.2746 9.23197 8.56342 6.63018 7.99857 4.85907 6.21945 5.85818 10.6679 7.36192 numMergedOcc 0
48 mol 148 unq 0 iso 0 dist 9.14135 9.14127 9.02318 14.7238 9.74542 6.83844 15.3515 8.12589 12.144 10.2478 numMergedOcc 0
49 mol 148 unq 0 iso 1 dist 9.14135 14.7238 9.74542 9.14127 9.02318 6.83844 15.3515 8.12589 10.2478 12.144 numMergedOcc 0
50 mol 148 unq 1 iso 0 dist 9.14135 9.14127 9.02318 11.3515 7.97543 7.26616 15.3515 8.12589 12.144 6.29254 numMergedOcc 0
51 mol 148 unq 1 iso 1 dist 9.14135 11.3515 7.97543 9.14127 9.02318 7.26616 15.3515 8.12589 6.29254 12.144 numMergedOcc 0
52 mol 148 unq 1 iso 0 dist 9.14135 14.7238 9.74542 11.3515 7.97543 8.72919 15.3515 8.12589 10.2478 6.29254 numMergedOcc 0
53 mol 148 unq 1 iso 1 dist 9.14135 11.3515 7.97543 14.7238 9.74542 8.72919 15.3515 8.12589 6.29254 10.2478 numMergedOcc 0
54 mol 150 unq 0 iso 0 dist 9.12067 14.7649 9.6606 11.4349 7.85526 8.77324 15.4401 8.11592 10.2318 6.25747 numMergedOcc 0
55 mol 150 unq 0 iso 1 dist 9.12067 11.4349 7.85526 14.7649 9.6606 8.77324 15.4401 8.11592 6.25747 10.2318 numMergedOcc 0
56 mol 150 unq 1 iso 0 dist 9.12067 14.7649 9.6606 9.10666 8.94552 6.98865 15.4401 8.11592 10.2318 12.154 numMergedOcc 0
57 mol 150 unq 1 iso 1 dist 9.12067 9.10666 8.94552 14.7649 9.6606 6.98865 15.4401 8.11592 12.154 10.2318 numMergedOcc 0
58 mol 150 unq 1 iso 0 dist 9.12067 11.4349 7.85526 9.10666 8.94552 7.24908 15.4401 8.11592 6.25747 12.154 numMergedOcc 0
59 mol 150 unq 1 iso 1 dist 9.12067 9.10666 8.94552 11.4349 7.85526 7.24908 15.4401 8.11592 12.154 6.25747 numMergedOcc 0
60 mol 156 unq 0 iso 0 dist 7.96867 6.205 9.31851 10.0792 6.2319 7.14831 7.00982 9.54367 10.5873 13.2847 numMergedOcc 0
61 mol 156 unq 0 iso 1 dist 7.96867 10.0792 6.2319 6.205 9.31851 7.14831 7.00982 9.54367 13.2847 10.5873 numMergedOcc 0
62 mol 156 unq 1 iso 0 dist 7.96867 6.205 9.31851 10.0792 6.2319 7.14831 7.69314 7.26859 4.73711 5.97294 numMergedOcc 0
63 mol 156 unq 1 iso 1 dist 7.96867 10.0792 6.2319 6.205 9.31851 7.14831 7.69314 7.26859 5.97294 4.73711 numMergedOcc 0
64 mol 156 unq 2 iso 0 dist 7.96867 6.205 9.31851 13.8503 9.97732 9.98789 7.00982 9.54367 10.5873 14.42 numMergedOcc 0
65 mol 156 unq 2 iso 1 dist 7.96867 13.8503 9.97732 6.205 9.31851 9.98789 7.00982 9.54367 14.42 10.5873 numMergedOcc 0
66 mol 156 unq 3 iso 0 dist 7.96867 6.205 9.31851 13.8503 9.97732 9.98789 7.69314 7.26859 4.73711 6.53729 numMergedOcc 0
67 mol 156 unq 3 iso 1 dist 7.96867 13.8503 9.97732 6.205 9.31851 9.98789 7.69314 7.26859 6.53729 4.73711 numMergedOcc 0
68 mol 156 unq 2 iso 0 dist 7.96867 10.0792 6.2319 13.8503 9.97732 6.31306 7.00982 9.54367 13.2847 14.42 numMergedOcc 0
69 mol 156 unq 2 iso 1 dist 7.96867 13.8503 9.97732 10.0792 6.2319 6.31306 7.00982 9.54367 14.42 13.2847 numMergedOcc 0
70 mol 156 unq 3 iso 0 dist 7.96867 10.0792 6.2319 13.8503 9.97732 6.31306 7.69314 7.26859 5.97294 6.53729 numMergedOcc 0
71 mol 156 unq 3 iso 1 dist 7.96867 13.8503 9.97732 10.0792 6.2319 6.31306 7.69314 7.26859 6.53729 5.97294 numMergedOcc 0
72 mol 204 unq 0 iso 0 dist 8.28297 7.37147 8.0144 13.1366 7.80841 11.117 13.1818 8.50907 14.8202 7.0418 numMergedOcc 0
73 mol 204 unq 0 iso 1 dist 8.28297 13.1366 7.80841 7.37147 8.0144 11.117 13.1818 8.50907 7.0418 14.8202 numMergedOcc 0
74 mol 205 unq 0 iso 0 dist 8.01082 4.87114 8.44861 9.43922 5.60393 7.38516 7.13867 5.42696 8.66809 6.23291 numMergedOcc 0
75 mol 205 unq 0 iso 1 dist 8.01082 9.43922 5.60393 4.87114 8.44861 7.38516 7.13867 5.42696 6.23291 8.66809 numMergedOcc 0
76 mol 214 unq 0 iso 0 dist 8.45863 11.4345 7.05523 7.3913 8.46327 12.7897 5.23668 7.2498 7.62375 10.7373 numMergedOcc 0
77 mol 214 unq 0 iso 1 dist 8.45863 7.3913 8.46327 11.4345 7.05523 12.7897 5.23668 7.2498 10.7373 7.62375 numMergedOcc 0
78 mol 230 unq 0 iso 0 dist 9.03723 11.958 9.09271 6.49467 7.44838 5.53477 8.36854 8.85215 11.2344 8.44099 numMergedOcc 0
79 mol 230 unq 0 iso 1 dist 9.03723 6.49467 7.44838 11.958 9.09271 5.53477 8.36854 8.85215 8.44099 11.2344 numMergedOcc 0
80 mol 261 unq 0 iso 0 dist 9.39571 6.42225 5.26434 11.0363 8.60026 7.00201 13.3708 9.24121 7.49174 5.22253 numMergedOcc 0
81 mol 261 unq 0 iso 1 dist 9.39571 11.0363 8.60026 6.42225 5.26434 7.00201 13.3708 9.24121 5.22253 7.49174 numMergedOcc 0
