0 mol 24 unq 0 iso 0 dist 7.84552 8.3964 3.4435 5.65754 7.19357 9.63925 10.0962 7.18124 7.85986 8.25818 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 7.84552 8.3964 3.4435 5.65754 7.19357 9.63925 8.56474 6.47026 4.30252 10.2171 numMergedOcc 0
2 mol 30 unq 0 iso 0 dist 7.75449 8.90581 6.37795 7.88072 3.30907 5.6849 4.83638 9.13786 12.7096 9.63882 numMergedOcc 0
3 mol 30 unq 1 iso 0 dist 7.75449 8.90581 6.37795 7.88072 3.30907 5.6849 5.2103 8.56807 9.94082 6.87277 numMergedOcc 0
4 mol 62 unq 0 iso 0 dist 8.22018 9.79863 13.3912 7.61377 9.23222 5.77803 7.31044 5.83263 15.3966 12.5231 numMergedOcc 0
5 mol 63 unq 0 iso 0 dist 9.25631 5.55574 12.2845 6.89855 5.98039 7.1742 5.04771 7.73753 9.50826 8.14512 numMergedOcc 0
6 mol 85 unq 0 iso 0 dist 8.96872 8.83135 6.64001 9.43839 11.4354 5.22259 9.99421 8.87977 6.46549 8.49871 numMergedOcc 0
7 mol 93 unq 0 iso 0 dist 8.70907 7.13064 5.39918 8.55758 9.96742 5.64998 9.6722 6.9447 5.56839 10.8976 numMergedOcc 0
8 mol 93 unq 1 iso 0 dist 8.70907 7.13064 5.39918 7.44027 7.75947 4.76749 9.6722 6.9447 5.56839 10.3155 numMergedOcc 0
9 mol 93 unq 2 iso 0 dist 8.70907 7.8962 9.73503 8.55758 9.96742 4.34681 9.6722 6.9447 7.83506 10.8976 numMergedOcc 0
10 mol 93 unq 3 iso 0 dist 8.70907 7.8962 9.73503 7.44027 7.75947 5.73248 9.6722 6.9447 7.83506 10.3155 numMergedOcc 0
11 mol 158 unq 0 iso 0 dist 9.07685 8.07946 6.03833 9.27714 10.9272 11.5349 5.34159 9.56702 7.20362 13.9538 numMergedOcc 0
12 mol 162 unq 0 iso 0 dist 7.80955 9.31025 8.06906 9.88912 5.77936 6.17752 7.86779 9.67872 5.67088 10.7246 numMergedOcc 0
13 mol 162 unq 1 iso 0 dist 7.80955 9.31025 8.06906 9.46218 12.2501 15.8538 7.86779 9.67872 5.67088 16.8281 numMergedOcc 0
14 mol 162 unq 2 iso 0 dist 7.93307 9.31025 15.1574 9.88912 12.3926 6.17752 10.5848 8.70516 16.504 15.9243 numMergedOcc 0
15 mol 162 unq 3 iso 0 dist 7.93307 9.31025 15.1574 9.46218 6.41455 15.8538 10.5848 8.70516 16.504 14.8826 numMergedOcc 0
16 mol 184 unq 0 iso 0 dist 5.67457 4.88303 4.53585 8.5544 5.05833 8.00739 4.75805 6.03495 5.12964 10.7976 numMergedOcc 0
17 mol 230 unq 0 iso 0 dist 7.5725 8.85051 6.78617 8.01593 3.28958 6.2222 4.45276 8.89873 12.4872 9.47092 numMergedOcc 0
