0 mol 0 unq 0 iso 0 dist 6.51408 6.22902 8.84413 8.53102 7.74146 5.79741 11.0503 12.5665 8.74302 5.91458 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 6.51408 4.80868 7.96742 10.9016 12.7706 7.19397 10.296 11.962 5.55156 6.83587 numMergedOcc 0
2 mol 0 unq 2 iso 0 dist 8.53102 6.22902 5.79741 6.51408 7.74146 8.84413 11.0503 5.91458 8.74302 12.5665 numMergedOcc 0
3 mol 7 unq 0 iso 0 dist 6.10226 10.5313 8.0166 5.80034 5.63739 9.32945 8.88982 5.70161 6.22805 4.57188 numMergedOcc 0
4 mol 7 unq 1 iso 0 dist 6.10226 10.5313 8.0166 9.83056 10.2796 9.90117 8.88982 5.70161 6.22805 6.09254 numMergedOcc 0
5 mol 7 unq 2 iso 0 dist 5.80034 10.5313 9.32945 6.10226 5.63739 8.0166 8.88982 4.57188 6.22805 5.70161 numMergedOcc 0
6 mol 7 unq 3 iso 0 dist 5.80034 10.5313 9.32945 9.83056 5.38328 9.90117 8.88982 4.57188 6.22805 6.09254 numMergedOcc 0
7 mol 7 unq 4 iso 0 dist 9.83056 10.5313 9.90117 6.10226 10.2796 8.0166 8.88982 6.09254 6.22805 5.70161 numMergedOcc 0
8 mol 7 unq 5 iso 0 dist 9.83056 10.5313 9.90117 5.80034 5.38328 9.32945 8.88982 6.09254 6.22805 4.57188 numMergedOcc 0
9 mol 12 unq 0 iso 0 dist 9.86138 13.1993 5.9021 21.63 12.3127 8.98466 17.4292 7.58748 8.17618 6.89226 numMergedOcc 0
10 mol 12 unq 1 iso 0 dist 5.76006 5.77108 5.9021 13.3953 12.3127 8.98466 10.9157 7.58748 8.17618 6.89226 numMergedOcc 0
11 mol 38 unq 0 iso 0 dist 7.98333 5.39032 7.55357 9.81175 9.56267 5.86972 6.46781 5.29179 8.86547 10.4994 numMergedOcc 0
12 mol 48 unq 0 iso 0 dist 7.77714 13.11 6.01454 14.2052 8.29103 8.36915 17.0309 9.26483 5.36645 8.03277 numMergedOcc 0
13 mol 48 unq 1 iso 0 dist 6.46118 4.99432 6.01454 10.7326 8.29103 8.36915 10.3214 9.26483 5.36645 8.03277 numMergedOcc 0
14 mol 64 unq 0 iso 0 dist 5.65519 6.25629 6.17846 12.5445 8.91253 8.14932 10.0975 5.33496 8.66921 9.82646 numMergedOcc 0
15 mol 175 unq 0 iso 0 dist 8.12739 9.30712 6.03184 16.8725 12.0951 8.6609 12.4121 7.28617 6.73365 6.15969 numMergedOcc 0
16 mol 175 unq 1 iso 0 dist 8.12739 9.30712 6.03184 16.8725 12.0951 8.6609 12.1014 5.77256 9.45659 11.0866 numMergedOcc 0
17 mol 175 unq 2 iso 0 dist 8.12739 9.30712 6.03184 16.8725 12.0951 8.6609 12.6945 4.96871 9.44856 13.5907 numMergedOcc 0
18 mol 175 unq 3 iso 0 dist 8.12739 9.30712 6.03184 14.0447 7.01839 6.21546 12.4121 7.28617 6.73365 5.50014 numMergedOcc 0
19 mol 175 unq 4 iso 0 dist 8.12739 9.30712 6.03184 14.0447 7.01839 6.21546 12.1014 5.77256 9.45659 7.39186 numMergedOcc 0
20 mol 175 unq 5 iso 0 dist 8.12739 9.30712 6.03184 14.0447 7.01839 6.21546 12.6945 4.96871 9.44856 7.05768 numMergedOcc 0
21 mol 210 unq 0 iso 0 dist 8.14413 12.3207 6.24111 12.3596 9.07869 8.60412 7.86668 5.82028 8.07523 4.62641 numMergedOcc 0
22 mol 210 unq 1 iso 0 dist 8.14413 12.2935 9.00343 12.3596 9.07869 7.05535 7.86668 5.82028 7.56882 4.62641 numMergedOcc 0
23 mol 220 unq 0 iso 0 dist 8.98518 9.07015 8.98362 12.9573 13.3644 7.57716 9.23844 6.80494 9.85951 9.86723 numMergedOcc 0
24 mol 220 unq 1 iso 0 dist 9.3888 5.58779 8.98362 13.1413 13.3644 7.57716 13.3756 6.80494 9.85951 9.86723 numMergedOcc 0
25 mol 238 unq 0 iso 0 dist 6.86905 5.98533 5.33462 10.9762 4.85921 6.74214 6.51823 7.22173 8.89538 10.4952 numMergedOcc 0
26 mol 238 unq 1 iso 0 dist 6.86905 5.98533 5.33462 10.9762 4.85921 6.74214 10.7019 5.96552 7.98022 6.62361 numMergedOcc 0
27 mol 250 unq 0 iso 0 dist 7.50654 9.84123 8.38141 10.3774 5.01048 5.08366 13.6825 7.64126 8.60184 5.03985 numMergedOcc 0
28 mol 250 unq 1 iso 0 dist 7.50654 9.84123 8.38141 13.7539 12.269 8.18086 13.6825 7.64126 8.60184 8.69877 numMergedOcc 0
29 mol 258 unq 0 iso 0 dist 8.8726 4.69752 7.70189 10.6825 9.86352 6.08181 14.1869 10.4667 9.67877 5.09738 numMergedOcc 0
30 mol 258 unq 1 iso 0 dist 8.8726 4.69752 7.70189 10.6825 9.86352 6.08181 5.31858 9.22664 8.81059 13.8694 numMergedOcc 0
31 mol 258 unq 2 iso 0 dist 8.8726 4.69752 7.70189 10.6825 9.86352 6.08181 5.71851 13.0489 9.12006 14.0402 numMergedOcc 0
