0 mol 0 unq 0 iso 0 dist 9.86169 5.64752 8.9753 6.00353 9.00092 10.4086 numMergedOcc 0
1 mol 21 unq 0 iso 0 dist 7.01513 5.24786 6.29808 6.50188 5.63735 4.09637 numMergedOcc 0
2 mol 21 unq 1 iso 0 dist 8.09082 11.61 6.29808 7.9574 5.63735 4.09637 numMergedOcc 0
3 mol 21 unq 2 iso 0 dist 7.5136 11.61 7.46409 7.9574 6.28263 4.09637 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 8.48944 10.0482 5.22014 12.5434 4.44526 4.98286 numMergedOcc 0
5 mol 24 unq 1 iso 0 dist 8.48944 10.0482 5.22014 11.8259 9.586 12.988 numMergedOcc 0
6 mol 34 unq 0 iso 0 dist 5.39587 9.05146 5.51172 7.58383 6.88052 4.4218 numMergedOcc 0
7 mol 41 unq 0 iso 0 dist 4.29713 10.1173 6.64721 7.50942 6.21128 8.92159 numMergedOcc 0
8 mol 41 unq 1 iso 0 dist 4.29713 10.1173 6.64721 12.6976 9.57024 6.87608 numMergedOcc 0
9 mol 41 unq 2 iso 0 dist 4.29713 11.2861 9.36169 7.50942 6.21128 6.17678 numMergedOcc 0
10 mol 41 unq 3 iso 0 dist 4.29713 11.2861 9.36169 12.6976 9.57024 4.28783 numMergedOcc 0
11 mol 68 unq 0 iso 0 dist 6.09085 11.9238 8.8014 13.0367 7.98985 6.78661 numMergedOcc 0
12 mol 73 unq 0 iso 0 dist 5.91019 4.32836 6.22872 5.67536 5.7684 3.99262 numMergedOcc 0
13 mol 93 unq 0 iso 0 dist 7.49235 7.1496 9.43355 12.8733 9.19977 17.826 numMergedOcc 0
14 mol 93 unq 1 iso 0 dist 7.49235 7.1496 9.43355 11.3276 7.28831 16.0131 numMergedOcc 0
15 mol 93 unq 2 iso 0 dist 7.49235 7.1496 9.43355 7.81661 9.71411 11.7408 numMergedOcc 0
16 mol 98 unq 0 iso 0 dist 5.91797 14.0128 8.65429 6.3915 9.25444 14.1628 numMergedOcc 0
17 mol 98 unq 1 iso 0 dist 5.91797 14.0128 8.65429 5.081 8.46823 16.4829 numMergedOcc 0
18 mol 98 unq 2 iso 0 dist 6.37954 11.8219 5.44426 6.3915 9.84703 14.3798 numMergedOcc 0
19 mol 98 unq 3 iso 0 dist 6.37954 11.8219 5.44426 5.081 4.62494 9.0917 numMergedOcc 0
20 mol 169 unq 0 iso 0 dist 9.70796 6.33958 8.66311 4.67112 6.05009 6.07908 numMergedOcc 0
21 mol 222 unq 0 iso 0 dist 8.61619 10.995 8.79662 8.51744 8.23406 10.4451 numMergedOcc 0
22 mol 232 unq 0 iso 0 dist 8.1692 9.48135 8.22129 5.70548 6.59036 5.79979 numMergedOcc 0
