0 mol 0 unq 0 iso 0 dist 6.8892 5.55156 5.85361 7.1599 11.788 7.15528 11.0073 15.0946 9.46298 7.40865 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 9.02869 5.83658 5.37308 10.826 12.421 9.60499 9.89388 6.44558 6.55304 6.7985 numMergedOcc 0
2 mol 7 unq 1 iso 0 dist 9.02869 5.83658 5.37308 10.826 12.421 9.60499 14.2616 12.3055 12.2869 6.44736 numMergedOcc 0
3 mol 7 unq 2 iso 0 dist 7.38748 6.22892 5.0893 7.15287 6.8464 8.41585 12.916 9.85147 12.0193 5.99972 numMergedOcc 0
4 mol 19 unq 0 iso 0 dist 8.75001 7.84393 12.48 9.01721 17.1733 7.82074 10.7145 16.4021 6.01808 6.41575 numMergedOcc 0
5 mol 24 unq 0 iso 0 dist 7.69637 6.85331 9.1927 9.20254 12.0295 6.86014 13.4332 14.7728 6.66749 9.41441 numMergedOcc 0
6 mol 24 unq 1 iso 0 dist 9.22152 5.87895 6.7228 5.75653 13.3202 7.36323 14.0475 19.8091 13.2229 8.4051 numMergedOcc 0
7 mol 24 unq 2 iso 0 dist 9.22152 5.87895 6.7228 5.75653 13.3202 7.36323 7.06532 10.658 6.38336 8.23446 numMergedOcc 0
8 mol 24 unq 3 iso 0 dist 9.22152 5.87895 6.7228 5.75653 13.3202 7.36323 11.0714 12.0962 6.7828 8.75662 numMergedOcc 0
9 mol 64 unq 0 iso 0 dist 8.86433 9.10915 14.8927 9.73304 16.8033 9.67592 12.219 15.7957 6.21578 9.97159 numMergedOcc 0
10 mol 64 unq 1 iso 0 dist 5.66803 5.54343 5.9853 5.59762 9.21546 9.67592 9.23947 8.95689 6.21578 9.97159 numMergedOcc 0
11 mol 73 unq 0 iso 0 dist 8.90896 5.79954 4.78435 12.8388 11.6724 9.96396 6.66506 5.00474 5.11416 9.24757 numMergedOcc 0
12 mol 115 unq 0 iso 0 dist 9.41083 7.83568 11.8582 7.10772 14.3348 5.11551 13.3321 18.4391 6.77806 6.92026 numMergedOcc 0
13 mol 115 unq 1 iso 0 dist 9.41083 7.83568 11.8582 11.3906 18.1828 7.11972 13.3321 18.4391 6.77806 5.88249 numMergedOcc 0
14 mol 143 unq 0 iso 0 dist 6.87456 5.30872 8.03483 6.3915 12.5106 5.99315 9.99577 13.339 6.48978 7.78652 numMergedOcc 0
15 mol 143 unq 1 iso 0 dist 6.87456 5.30872 8.03483 6.3915 12.5106 5.99315 10.2769 11.9283 5.20762 8.91301 numMergedOcc 0
16 mol 175 unq 0 iso 0 dist 7.03107 6.6776 4.51101 7.42609 9.81041 6.57069 8.79832 11.4777 8.29015 9.77896 numMergedOcc 0
17 mol 181 unq 0 iso 0 dist 8.92801 9.63295 9.40823 12.5935 12.8027 7.63312 17.0911 15.0936 12.5387 5.94469 numMergedOcc 0
18 mol 181 unq 1 iso 0 dist 9.40718 9.63295 5.32364 12.5935 11.9989 7.63312 17.0911 17.4989 12.5387 5.94469 numMergedOcc 0
19 mol 182 unq 0 iso 0 dist 8.27913 9.36307 8.27268 9.72559 10.8493 9.31746 13.0317 9.60932 7.68794 6.73956 numMergedOcc 0
20 mol 182 unq 1 iso 0 dist 8.27913 9.36307 8.27268 9.72559 10.8493 9.31746 14.8787 14.5682 9.37404 7.09394 numMergedOcc 0
21 mol 220 unq 0 iso 0 dist 9.89039 8.9077 13.6952 10.6943 15.6403 9.23153 7.46122 9.36068 7.11498 6.59716 numMergedOcc 0
22 mol 220 unq 1 iso 0 dist 8.57174 8.9077 13.8822 10.6943 18.2814 9.23153 7.46122 15.6078 7.11498 6.59716 numMergedOcc 0
23 mol 239 unq 0 iso 0 dist 8.48545 9.27989 13.3838 12.1502 17.0305 6.16342 12.9792 16.0645 4.30299 8.84636 numMergedOcc 0
24 mol 241 unq 0 iso 0 dist 7.26758 6.40592 7.3737 7.93809 12.8359 7.4631 10.2312 10.2767 4.45049 7.89524 numMergedOcc 0
25 mol 261 unq 0 iso 0 dist 8.88741 7.15785 6.43209 6.5875 7.30472 8.02547 11.3138 5.08716 5.91643 8.43974 numMergedOcc 0
26 mol 261 unq 1 iso 0 dist 8.88741 9.43169 7.78464 6.5875 7.30472 6.05727 11.3138 5.08716 5.02383 8.43974 numMergedOcc 0
