0 mol 1 unq 0 iso 0 dist 8.3673 6.28655 5.96833 9.48433 4.50502 8.56884 numMergedOcc 0
1 mol 15 unq 0 iso 0 dist 9.60736 6.66625 9.51568 4.89563 6.91314 9.29358 numMergedOcc 0
2 mol 20 unq 0 iso 0 dist 9.78431 10.6755 5.83917 16.5078 9.03258 6.4934 numMergedOcc 0
3 mol 20 unq 1 iso 0 dist 9.78431 10.6755 5.83917 12.8549 3.79581 6.93199 numMergedOcc 0
4 mol 58 unq 0 iso 0 dist 7.63443 6.1599 7.60018 13.1048 7.00806 9.33535 numMergedOcc 0
5 mol 58 unq 1 iso 0 dist 7.63443 6.1599 7.60018 10.079 6.20618 8.26899 numMergedOcc 0
6 mol 58 unq 2 iso 0 dist 5.40287 6.1599 7.03126 13.1048 9.53718 9.33535 numMergedOcc 0
7 mol 58 unq 3 iso 0 dist 5.40287 6.1599 7.03126 10.079 5.61579 8.26899 numMergedOcc 0
8 mol 182 unq 0 iso 0 dist 6.39008 7.08648 5.73635 6.32172 4.88992 6.73313 numMergedOcc 0
9 mol 213 unq 0 iso 0 dist 8.38459 5.06267 8.65196 10.8844 10.1881 6.0965 numMergedOcc 0
10 mol 213 unq 1 iso 0 dist 8.38459 4.91881 5.461 9.24466 4.72944 8.45368 numMergedOcc 0
11 mol 213 unq 2 iso 0 dist 8.38459 4.91881 5.461 10.8844 10.1881 9.59129 numMergedOcc 0
12 mol 233 unq 0 iso 0 dist 7.86214 6.99665 6.01775 9.39439 6.8325 9.43203 numMergedOcc 0
13 mol 233 unq 1 iso 0 dist 5.29501 4.43794 6.01775 10.8847 6.8325 9.43203 numMergedOcc 0
14 mol 233 unq 2 iso 0 dist 8.81206 11.2489 6.01775 14.0377 6.8325 9.43203 numMergedOcc 0
15 mol 234 unq 0 iso 0 dist 4.37501 5.04225 8.27411 7.17987 3.95629 9.5707 numMergedOcc 0
16 mol 234 unq 1 iso 0 dist 4.37501 6.99882 7.36208 8.58958 5.53885 6.25105 numMergedOcc 0
17 mol 234 unq 2 iso 0 dist 4.37501 6.99882 7.36208 7.17987 3.95629 7.85175 numMergedOcc 0
18 mol 259 unq 0 iso 0 dist 9.93282 11.4659 6.23661 11.283 10.067 7.48005 numMergedOcc 0
19 mol 259 unq 1 iso 0 dist 9.93282 11.4659 6.23661 16.7971 7.09907 8.37865 numMergedOcc 0
20 mol 267 unq 0 iso 0 dist 8.63426 10.8336 6.32877 19.0047 11.5903 8.76007 numMergedOcc 0
21 mol 267 unq 1 iso 0 dist 8.04091 7.37981 6.32877 14.6994 11.5903 8.76007 numMergedOcc 0
