0 mol 1 unq 0 iso 0 dist 8.55986 7.9623 6.52516 9.29949 9.00146 13.791 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 8.55986 8.32001 6.37896 9.29949 9.00146 12.9701 numMergedOcc 0
2 mol 46 unq 0 iso 0 dist 8.71639 9.68034 13.6567 6.31018 4.28397 9.43025 numMergedOcc 0
3 mol 59 unq 0 iso 0 dist 6.5121 6.46204 6.58127 8.59468 4.58582 4.83907 numMergedOcc 0
4 mol 63 unq 0 iso 0 dist 5.16082 9.70386 12.5929 6.2616 7.60185 5.66383 numMergedOcc 0
5 mol 63 unq 1 iso 0 dist 5.16082 9.70386 12.5929 9.38026 13.7081 4.5476 numMergedOcc 0
6 mol 63 unq 2 iso 0 dist 5.16082 9.70386 12.5929 8.6691 11.2297 15.7938 numMergedOcc 0
7 mol 76 unq 0 iso 0 dist 7.76963 4.65085 5.22567 8.06915 8.66335 6.1999 numMergedOcc 0
8 mol 135 unq 0 iso 0 dist 9.26556 6.14743 5.23554 9.41577 12.855 13.5317 numMergedOcc 0
9 mol 135 unq 1 iso 0 dist 9.26556 7.64736 4.8565 9.41577 12.855 10.074 numMergedOcc 0
10 mol 175 unq 0 iso 0 dist 7.72575 8.70051 6.07729 5.97221 9.36968 6.28491 numMergedOcc 0
11 mol 175 unq 1 iso 0 dist 7.72575 8.70051 6.07729 8.75176 12.929 9.08894 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 5.51789 8.32825 4.60893 7.60933 9.64122 12.1825 numMergedOcc 0
13 mol 186 unq 1 iso 0 dist 5.51789 8.32825 4.60893 5.01241 8.74196 11.1512 numMergedOcc 0
14 mol 186 unq 2 iso 0 dist 5.63228 8.32825 8.32736 7.60933 7.3699 12.1825 numMergedOcc 0
15 mol 186 unq 3 iso 0 dist 5.63228 8.32825 8.32736 5.01241 5.14141 11.1512 numMergedOcc 0
16 mol 210 unq 0 iso 0 dist 8.9719 9.65874 13.3368 9.16485 10.5877 17.8718 numMergedOcc 0
17 mol 210 unq 1 iso 0 dist 8.9719 9.65874 13.3368 7.10624 8.29342 16.1889 numMergedOcc 0
18 mol 244 unq 0 iso 0 dist 8.5122 8.1086 10.3867 9.61788 9.6651 4.48096 numMergedOcc 0
