0 mol 7 unq 0 iso 0 dist 8.88982 11.2808 7.15434 14.92 8.72114 10.7937 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 6.60918 8.99471 8.4361 5.9861 6.62144 5.06195 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 6.80849 6.27332 8.20058 14.1707 8.60554 13.4836 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 6.80849 6.27332 8.20058 6.3045 8.44664 11.9824 numMergedOcc 0
4 mol 24 unq 2 iso 0 dist 6.80849 6.27332 8.20058 9.47767 9.44691 9.04355 numMergedOcc 0
5 mol 30 unq 0 iso 0 dist 9.28346 8.4541 9.28932 6.51677 7.12365 5.2347 numMergedOcc 0
6 mol 30 unq 1 iso 0 dist 9.28346 8.66179 7.53042 6.51677 7.12365 5.9029 numMergedOcc 0
7 mol 41 unq 0 iso 0 dist 9.02927 10.1432 8.52313 11.098 8.51663 8.06801 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 4.31067 5.88769 8.05602 9.0917 6.65501 11.0132 numMergedOcc 0
9 mol 113 unq 0 iso 0 dist 8.29529 4.5845 9.08014 5.89952 8.8822 10.3234 numMergedOcc 0
10 mol 113 unq 1 iso 0 dist 8.29529 4.5845 9.08014 5.58964 9.66219 9.4626 numMergedOcc 0
11 mol 125 unq 0 iso 0 dist 9.50809 6.43724 7.76202 6.27909 7.47069 7.74181 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 8.29673 14.7174 9.79004 5.42142 7.71248 13.2968 numMergedOcc 0
13 mol 174 unq 0 iso 0 dist 6.90813 10.67 6.04817 6.07412 8.87569 10.981 numMergedOcc 0
14 mol 174 unq 1 iso 0 dist 6.90813 10.67 6.04817 7.20832 9.87122 13.6211 numMergedOcc 0
15 mol 205 unq 0 iso 0 dist 6.04106 5.60686 6.15806 4.45301 5.44002 5.07333 numMergedOcc 0
16 mol 212 unq 0 iso 0 dist 8.13678 16.2018 9.47932 12.4498 9.74144 9.63106 numMergedOcc 0
17 mol 212 unq 1 iso 0 dist 8.13678 16.2018 9.47932 10.0809 8.69988 10.6561 numMergedOcc 0
18 mol 212 unq 2 iso 0 dist 8.13678 16.2018 9.47932 6.27773 8.55903 15.0782 numMergedOcc 0
19 mol 212 unq 3 iso 0 dist 8.13678 16.2018 9.47932 10.1594 7.15603 7.56072 numMergedOcc 0
20 mol 213 unq 0 iso 0 dist 8.48081 13.949 9.75141 12.2528 8.14332 10.9044 numMergedOcc 0
21 mol 240 unq 0 iso 0 dist 7.0935 14.8415 9.68888 12.7219 6.68687 5.24149 numMergedOcc 0
