0 mol 0 unq 0 iso 0 dist 9.23213 5.24778 8.34244 12.9149 8.66548 8.73015 15.3236 14.2251 13.3675 9.72725 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 6.36911 5.03847 9.97624 6.88805 8.81608 5.5683 10.5461 10.515 8.72114 9.67164 numMergedOcc 0
2 mol 7 unq 1 iso 0 dist 6.36911 5.03847 9.97624 6.88805 8.81608 5.5683 8.41585 6.06176 10.3148 5.99459 numMergedOcc 0
3 mol 7 unq 2 iso 0 dist 9.36807 13.8829 9.97624 13.156 8.81608 5.5683 7.10621 10.515 8.72114 9.67164 numMergedOcc 0
4 mol 7 unq 3 iso 0 dist 9.36807 13.8829 9.97624 13.156 8.81608 5.5683 12.2333 6.06176 10.3148 5.99459 numMergedOcc 0
5 mol 15 unq 0 iso 0 dist 9.29358 9.75966 6.50647 6.91314 9.51568 5.20798 11.3543 6.67334 6.42748 8.85174 numMergedOcc 0
6 mol 18 unq 0 iso 0 dist 8.52106 10.6757 8.80193 6.11048 5.04478 11.0746 11.103 7.04695 15.3722 5.65084 numMergedOcc 0
7 mol 18 unq 1 iso 0 dist 6.32451 7.62011 8.80193 4.52259 5.04478 11.0746 9.94539 7.04695 15.3722 5.65084 numMergedOcc 0
8 mol 45 unq 0 iso 0 dist 9.20119 10.7082 5.55096 12.466 5.81001 4.06745 15.0348 7.39653 9.49841 5.94756 numMergedOcc 0
9 mol 58 unq 0 iso 0 dist 8.81638 9.62267 7.6481 6.07871 8.13051 5.45005 12.6159 10.3598 12.9819 9.97769 numMergedOcc 0
10 mol 58 unq 1 iso 0 dist 8.81638 9.62267 7.6481 6.07871 8.13051 5.45005 10.3617 6.00578 11.3538 9.32706 numMergedOcc 0
11 mol 58 unq 2 iso 0 dist 8.81638 9.62267 7.6481 6.07871 8.13051 5.45005 14.5434 11.6697 9.86039 9.08221 numMergedOcc 0
12 mol 76 unq 0 iso 0 dist 6.21982 4.85247 7.03226 5.31985 9.4866 10.1364 10.0992 10.963 13.9633 8.13108 numMergedOcc 0
13 mol 76 unq 1 iso 0 dist 8.19682 6.45686 7.03226 15.4159 9.4866 10.1364 16.758 10.963 13.9633 8.13108 numMergedOcc 0
14 mol 115 unq 0 iso 0 dist 7.76729 14.0688 7.70313 6.63111 8.0168 10.3264 9.33865 10.7942 13.3009 6.39384 numMergedOcc 0
15 mol 115 unq 1 iso 0 dist 7.76729 14.0688 7.70313 6.63111 8.0168 10.3264 5.83991 10.9739 17.0848 9.42082 numMergedOcc 0
16 mol 115 unq 2 iso 0 dist 7.64585 6.40494 7.52142 6.95773 7.65255 6.44969 9.33865 10.2377 12.125 6.24825 numMergedOcc 0
17 mol 119 unq 0 iso 0 dist 7.39889 5.92984 7.26955 14.443 9.08536 14.9264 23.1442 16.7975 22.9076 8.95212 numMergedOcc 0
18 mol 119 unq 1 iso 0 dist 7.39889 5.92984 7.26955 14.443 9.08536 14.9264 14.5183 7.36192 14.2293 6.99446 numMergedOcc 0
19 mol 119 unq 2 iso 0 dist 7.39889 5.92984 7.26955 14.443 9.08536 14.9264 16.7981 10.6679 17.9198 7.64052 numMergedOcc 0
20 mol 119 unq 3 iso 0 dist 9.63176 15.5019 7.26955 9.68677 9.08536 14.9264 16.4353 16.7975 22.9076 8.95212 numMergedOcc 0
21 mol 119 unq 4 iso 0 dist 9.63176 15.5019 7.26955 9.68677 9.08536 14.9264 10.3704 7.36192 14.2293 6.99446 numMergedOcc 0
22 mol 119 unq 5 iso 0 dist 9.63176 15.5019 7.26955 9.68677 9.08536 14.9264 8.73993 10.6679 17.9198 7.64052 numMergedOcc 0
23 mol 119 unq 6 iso 0 dist 7.44174 10.314 7.26955 6.20019 9.08536 14.9264 13.9919 16.7975 22.9076 8.95212 numMergedOcc 0
24 mol 119 unq 7 iso 0 dist 7.44174 10.314 7.26955 6.20019 9.08536 14.9264 9.87172 7.36192 14.2293 6.99446 numMergedOcc 0
25 mol 119 unq 8 iso 0 dist 7.44174 10.314 7.26955 6.20019 9.08536 14.9264 12.6489 10.6679 17.9198 7.64052 numMergedOcc 0
26 mol 143 unq 0 iso 0 dist 7.31468 10.0059 6.46089 7.63293 7.05845 12.207 10.6877 6.01455 7.78652 7.36975 numMergedOcc 0
27 mol 143 unq 1 iso 0 dist 7.7056 8.57817 6.46089 11.903 7.05845 12.207 12.7524 6.01455 7.78652 7.36975 numMergedOcc 0
28 mol 181 unq 0 iso 0 dist 4.93785 7.77758 7.05653 6.8757 9.09234 4.98436 7.81386 6.7991 5.94469 6.64173 numMergedOcc 0
29 mol 181 unq 1 iso 0 dist 4.93785 7.77758 7.05653 5.71898 6.76746 11.9796 7.81386 6.7991 5.94469 9.01624 numMergedOcc 0
30 mol 181 unq 2 iso 0 dist 4.93785 7.77758 7.05653 5.71898 6.76746 11.9796 9.81747 8.35755 14.8638 5.05973 numMergedOcc 0
31 mol 181 unq 3 iso 0 dist 4.93785 7.77758 7.05653 5.83796 8.92098 12.3589 7.81386 6.7991 5.94469 9.55105 numMergedOcc 0
32 mol 259 unq 0 iso 0 dist 7.48005 8.81835 8.71497 10.282 8.84648 7.57379 12.0576 5.31048 10.4552 8.03219 numMergedOcc 0
33 mol 259 unq 1 iso 0 dist 7.48005 8.81835 8.71497 10.067 6.23661 4.47425 7.46176 5.79468 7.08526 5.85442 numMergedOcc 0
34 mol 259 unq 2 iso 0 dist 7.48005 8.81835 8.71497 10.067 6.23661 4.47425 12.0576 5.31048 10.4552 6.9899 numMergedOcc 0
35 mol 259 unq 3 iso 0 dist 8.37865 8.75685 8.71497 4.04513 8.84648 7.57379 5.30224 5.31048 10.4552 8.03219 numMergedOcc 0
36 mol 259 unq 4 iso 0 dist 8.37865 8.75685 8.71497 7.09907 6.23661 4.47425 11.858 5.79468 7.08526 5.85442 numMergedOcc 0
37 mol 259 unq 5 iso 0 dist 8.37865 8.75685 8.71497 7.09907 6.23661 4.47425 5.30224 5.31048 10.4552 6.9899 numMergedOcc 0
38 mol 267 unq 0 iso 0 dist 8.76007 9.33806 9.01354 9.22276 5.08174 5.68457 15.5427 7.11419 13.8725 8.8293 numMergedOcc 0
39 mol 267 unq 1 iso 0 dist 8.76007 9.33806 9.01354 9.22276 5.08174 5.68457 14.4611 6.45566 10.2761 7.34981 numMergedOcc 0
40 mol 274 unq 0 iso 0 dist 9.19234 5.64601 9.20749 8.87855 6.66172 5.39432 10.7806 5.31116 10.5387 6.4611 numMergedOcc 0
