0 mol 21 unq 0 iso 0 dist 9.88089 6.29808 12.5889 4.09637 12.1585 5.63735 numMergedOcc 0
1 mol 21 unq 1 iso 0 dist 9.88089 7.46409 9.69416 4.09637 12.1585 6.28263 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 9.43241 8.26412 10.9035 4.93307 12.6444 6.29797 numMergedOcc 0
3 mol 25 unq 1 iso 0 dist 6.45097 8.26412 13.6714 4.93307 9.86224 6.29797 numMergedOcc 0
4 mol 30 unq 0 iso 0 dist 9.46542 9.83449 8.28568 12.0074 16.5927 9.4577 numMergedOcc 0
5 mol 46 unq 0 iso 0 dist 9.30086 7.33624 11.846 6.31647 14.42 5.96231 numMergedOcc 0
6 mol 56 unq 0 iso 0 dist 9.39338 9.80869 6.66024 3.98831 10.8421 9.54323 numMergedOcc 0
7 mol 68 unq 0 iso 0 dist 8.52142 8.8014 11.1122 6.78661 13.8021 7.98985 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 6.86463 6.22872 5.56727 3.99262 7.80375 5.7684 numMergedOcc 0
9 mol 93 unq 0 iso 0 dist 9.27407 9.43355 10.5249 17.826 17.2414 9.19977 numMergedOcc 0
10 mol 93 unq 1 iso 0 dist 9.27407 9.43355 10.5249 16.0131 17.2011 7.28831 numMergedOcc 0
11 mol 93 unq 2 iso 0 dist 9.27407 9.43355 10.5249 11.7408 11.1616 9.71411 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 7.55581 7.33743 7.15161 8.11294 13.7414 8.83732 numMergedOcc 0
13 mol 141 unq 0 iso 0 dist 7.13657 4.54218 5.78168 4.37003 10.5022 5.92302 numMergedOcc 0
14 mol 141 unq 1 iso 0 dist 7.13657 4.54218 5.78168 4.34943 8.61279 5.29898 numMergedOcc 0
15 mol 141 unq 2 iso 0 dist 8.70917 8.36316 5.78168 9.86195 10.5022 5.92302 numMergedOcc 0
16 mol 141 unq 3 iso 0 dist 8.70917 8.36316 5.78168 4.50791 8.61279 5.29898 numMergedOcc 0
17 mol 181 unq 0 iso 0 dist 8.99149 9.19831 10.3569 6.15536 10.658 8.59681 numMergedOcc 0
18 mol 222 unq 0 iso 0 dist 8.37114 8.79662 5.13817 10.4451 8.8394 8.23406 numMergedOcc 0
19 mol 232 unq 0 iso 0 dist 8.24059 8.22129 9.91412 5.79979 12.5322 6.59036 numMergedOcc 0
