0 mol 11 unq 0 iso 0 dist 9.74528 17.4352 9.81983 13.2484 3.66215 9.09091 numMergedOcc 0
1 mol 17 unq 0 iso 0 dist 8.55161 16.3739 8.26398 16.9567 9.59996 9.877 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 8.26877 14.2257 7.11491 8.80334 4.28224 7.34031 numMergedOcc 0
3 mol 48 unq 1 iso 0 dist 7.99434 11.0398 7.11491 12.2147 4.28224 7.34031 numMergedOcc 0
4 mol 48 unq 2 iso 0 dist 7.49794 13.7393 7.1829 8.45484 4.12075 7.281 numMergedOcc 0
5 mol 48 unq 3 iso 0 dist 8.10222 11.0408 7.1829 12.1466 4.12075 7.281 numMergedOcc 0
6 mol 61 unq 0 iso 0 dist 9.0681 15.6049 9.83914 18.9003 10.3452 7.46994 numMergedOcc 0
7 mol 79 unq 0 iso 0 dist 7.75543 8.15741 6.72546 10.9758 4.35906 7.87237 numMergedOcc 0
8 mol 79 unq 1 iso 0 dist 6.65972 10.3307 8.33791 8.97897 8.42733 7.87237 numMergedOcc 0
9 mol 79 unq 2 iso 0 dist 4.2253 10.3307 7.38548 8.97897 4.89844 7.87237 numMergedOcc 0
10 mol 87 unq 0 iso 0 dist 6.21471 6.57984 9.41934 10.1385 8.53566 7.2268 numMergedOcc 0
11 mol 87 unq 1 iso 0 dist 6.21471 6.57984 9.41934 7.2668 3.63275 8.31175 numMergedOcc 0
12 mol 143 unq 0 iso 0 dist 9.99012 11.6598 7.2932 8.22353 4.19541 9.30424 numMergedOcc 0
13 mol 143 unq 1 iso 0 dist 5.33772 8.28318 7.2932 8.57285 4.19541 9.30424 numMergedOcc 0
14 mol 158 unq 0 iso 0 dist 9.27714 7.46548 4.6512 11.7748 5.30823 9.6096 numMergedOcc 0
15 mol 175 unq 0 iso 0 dist 8.06007 10.3139 4.51777 13.7519 6.54263 9.19117 numMergedOcc 0
16 mol 175 unq 1 iso 0 dist 8.06007 10.3139 4.51777 7.77669 3.63393 6.26365 numMergedOcc 0
17 mol 175 unq 2 iso 0 dist 8.06007 7.04147 4.9606 7.77669 3.63393 7.04177 numMergedOcc 0
18 mol 287 unq 0 iso 0 dist 8.17436 13.2009 9.25759 14.3641 8.99193 5.59555 numMergedOcc 0
19 mol 288 unq 0 iso 0 dist 8.17436 13.2009 9.25759 14.3641 8.99193 5.59555 numMergedOcc 0
20 mol 289 unq 0 iso 0 dist 8.17436 13.2009 9.25759 14.3641 8.99193 5.59555 numMergedOcc 0
