0 mol 64 unq 0 iso 0 dist 9.82294 7.89444 5.66803 12.954 7.77991 10.0913 12.8981 5.88036 6.08228 12.174 numMergedOcc 0
1 mol 64 unq 1 iso 0 dist 9.82294 7.89444 5.66803 6.84612 5.1488 5.68492 12.8981 5.88036 6.08228 9.82635 numMergedOcc 0
2 mol 64 unq 2 iso 0 dist 9.82294 18.0124 8.85416 12.954 7.77991 8.21081 12.8981 5.88036 9.86958 12.174 numMergedOcc 0
3 mol 64 unq 3 iso 0 dist 9.82294 18.0124 8.85416 6.84612 5.1488 11.6323 12.8981 5.88036 9.86958 9.82635 numMergedOcc 0
4 mol 79 unq 0 iso 0 dist 5.55798 6.05149 8.64686 9.59811 9.74201 15.6024 8.71103 9.57704 7.41952 15.8071 numMergedOcc 0
5 mol 79 unq 1 iso 0 dist 5.55798 6.05149 8.64686 11.9573 8.17967 13.7118 8.71103 9.57704 7.41952 17.0146 numMergedOcc 0
6 mol 114 unq 0 iso 0 dist 8.79677 11.5575 6.54778 8.32999 6.06039 5.84883 11.3418 4.84565 9.6874 10.8293 numMergedOcc 0
7 mol 114 unq 1 iso 0 dist 8.79677 11.5575 6.54778 5.28095 9.36502 10.9953 11.3418 4.84565 9.6874 13.5042 numMergedOcc 0
8 mol 129 unq 0 iso 0 dist 5.16531 12.2874 9.52061 8.39839 9.50776 9.66773 11.6486 7.12885 8.34427 11.2007 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 6.9268 8.75242 5.79195 14.1492 8.03691 7.50288 6.85651 5.35551 9.07294 10.4324 numMergedOcc 0
10 mol 133 unq 1 iso 0 dist 6.9268 14.0828 9.2759 14.1492 8.03691 8.01541 16.9398 10.8516 5.12189 8.49888 numMergedOcc 0
11 mol 133 unq 2 iso 0 dist 6.9268 14.0828 9.2759 14.1492 8.03691 8.01541 6.85651 5.35551 7.50126 10.4324 numMergedOcc 0
12 mol 133 unq 3 iso 0 dist 8.19166 6.45333 5.79195 10.749 8.03691 7.50288 7.03858 5.35551 9.07294 10.4324 numMergedOcc 0
13 mol 133 unq 4 iso 0 dist 8.19166 11.5586 9.2759 10.749 8.03691 8.01541 15.5532 10.8516 5.12189 8.49888 numMergedOcc 0
14 mol 133 unq 5 iso 0 dist 8.19166 11.5586 9.2759 10.749 8.03691 8.01541 7.03858 5.35551 7.50126 10.4324 numMergedOcc 0
15 mol 147 unq 0 iso 0 dist 5.47265 7.75436 5.32865 5.81847 9.80032 10.7118 8.52428 4.61905 9.13646 11.4803 numMergedOcc 0
16 mol 159 unq 0 iso 0 dist 8.20121 10.242 6.86212 10.5561 9.23757 3.90437 12.5372 8.83633 7.60912 11.3079 numMergedOcc 0
17 mol 183 unq 0 iso 0 dist 6.0782 5.66126 8.97652 9.54124 8.55287 13.7069 10.6152 9.01399 7.69421 16.5717 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 6.36789 12.6035 6.72718 9.58526 7.46024 9.77203 9.89709 6.12748 7.02662 13.0019 numMergedOcc 0
19 mol 230 unq 0 iso 0 dist 5.19913 6.28086 9.24729 5.26751 7.08409 10.2514 11.236 11.0843 6.88683 14.2362 numMergedOcc 0
20 mol 266 unq 0 iso 0 dist 7.3055 6.1113 6.57444 9.5105 9.35019 5.53503 10.0039 13.1376 9.63694 14.7501 numMergedOcc 0
21 mol 266 unq 1 iso 0 dist 7.3055 6.1113 6.57444 9.5105 9.35019 5.53503 10.8326 5.91091 6.58277 6.36049 numMergedOcc 0
22 mol 266 unq 2 iso 0 dist 7.3055 14.487 9.39714 9.5105 9.35019 11.3259 10.8326 5.91091 8.12204 6.36049 numMergedOcc 0
