0 mol 51 unq 0 iso 0 dist 4.97772 5.46557 6.50216 13.9347 13.7524 8.55004 numMergedOcc 0
1 mol 56 unq 0 iso 0 dist 7.6585 13.2331 9.60995 19.0874 12.3451 8.72833 numMergedOcc 0
2 mol 56 unq 1 iso 0 dist 8.79531 6.08048 9.60995 14.0932 12.3451 8.72833 numMergedOcc 0
3 mol 68 unq 0 iso 0 dist 8.56621 3.95228 6.88786 5.68303 9.86454 5.73908 numMergedOcc 0
4 mol 68 unq 1 iso 0 dist 8.56621 3.95228 6.88786 10.4048 6.30184 6.77421 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 5.60664 3.98918 6.70925 9.92962 7.78899 8.09675 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 5.60664 8.5233 8.95756 9.92962 7.78899 9.02753 numMergedOcc 0
7 mol 101 unq 0 iso 0 dist 5.58941 4.58154 5.5199 10.54 6.63446 7.22737 numMergedOcc 0
8 mol 102 unq 0 iso 0 dist 6.00241 7.35103 8.07962 5.90675 6.43211 9.22651 numMergedOcc 0
9 mol 102 unq 1 iso 0 dist 6.00241 4.11174 7.58908 5.90675 6.43211 5.32892 numMergedOcc 0
10 mol 117 unq 0 iso 0 dist 5.98822 4.36058 6.81489 9.87044 5.13142 9.83596 numMergedOcc 0
11 mol 119 unq 0 iso 0 dist 5.74521 4.62381 5.28955 10.2953 6.16644 9.00829 numMergedOcc 0
12 mol 147 unq 0 iso 0 dist 8.93408 11.2108 6.00651 13.3958 4.93993 9.21476 numMergedOcc 0
13 mol 258 unq 0 iso 0 dist 8.94629 11.4452 9.4886 19.4257 12.9877 9.52903 numMergedOcc 0
14 mol 264 unq 0 iso 0 dist 5.11475 9.34577 9.8799 11.855 7.84436 9.67311 numMergedOcc 0
15 mol 294 unq 0 iso 0 dist 6.20852 4.10727 5.27236 5.10476 9.06411 8.55037 numMergedOcc 0
16 mol 294 unq 1 iso 0 dist 6.20852 4.10727 5.27236 9.70056 7.05161 5.71656 numMergedOcc 0
