0 mol 24 unq 0 iso 0 dist 7.84552 5.65754 7.19357 10.0962 7.18124 8.25818 8.3964 3.4435 9.63925 7.85986 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 7.84552 5.65754 7.19357 8.56474 6.47026 10.2171 13.4394 9.4199 15.6943 7.03544 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 7.84552 5.65754 7.19357 8.56474 6.47026 10.2171 8.3964 3.4435 9.63925 4.30252 numMergedOcc 0
3 mol 62 unq 0 iso 0 dist 8.22018 7.61377 9.23222 7.31044 5.83263 12.5231 10.3526 10.029 13.564 8.21895 numMergedOcc 0
4 mol 85 unq 0 iso 0 dist 8.96872 9.43839 11.4354 9.99421 8.87977 8.49871 8.83135 6.64001 5.22259 6.46549 numMergedOcc 0
5 mol 93 unq 0 iso 0 dist 8.70907 8.55758 9.96742 9.6722 6.9447 10.8976 7.13064 5.39918 5.64998 5.56839 numMergedOcc 0
6 mol 93 unq 1 iso 0 dist 8.70907 8.55758 9.96742 9.6722 6.9447 10.8976 7.8962 9.73503 4.34681 7.83506 numMergedOcc 0
7 mol 93 unq 2 iso 0 dist 8.70907 7.44027 7.75947 9.6722 6.9447 10.3155 7.13064 5.39918 4.76749 5.56839 numMergedOcc 0
8 mol 93 unq 3 iso 0 dist 8.70907 7.44027 7.75947 9.6722 6.9447 10.3155 7.8962 9.73503 5.73248 7.83506 numMergedOcc 0
9 mol 158 unq 0 iso 0 dist 9.07685 9.27714 10.9272 5.34159 9.56702 13.9538 8.07946 6.03833 11.5349 7.20362 numMergedOcc 0
10 mol 162 unq 0 iso 0 dist 7.80955 9.88912 5.77936 7.86779 9.67872 10.7246 9.31025 8.06906 6.17752 5.67088 numMergedOcc 0
11 mol 162 unq 1 iso 0 dist 7.80955 9.88912 5.77936 7.86779 9.67872 10.7246 13.7906 11.3156 7.76086 9.61332 numMergedOcc 0
12 mol 162 unq 2 iso 0 dist 7.80955 9.46218 12.2501 7.86779 9.67872 16.8281 9.31025 8.06906 15.8538 5.67088 numMergedOcc 0
13 mol 162 unq 3 iso 0 dist 7.80955 9.46218 12.2501 7.86779 9.67872 16.8281 13.7906 11.3156 19.1909 9.61332 numMergedOcc 0
14 mol 184 unq 0 iso 0 dist 5.67457 8.5544 5.05833 4.75805 6.03495 10.7976 4.88303 4.53585 8.00739 5.12964 numMergedOcc 0
15 mol 287 unq 0 iso 0 dist 8.71214 8.17436 7.67746 9.08224 9.97939 4.68668 16.4703 12.4081 9.88575 8.58427 numMergedOcc 0
16 mol 288 unq 0 iso 0 dist 8.71214 8.17436 7.67746 9.08224 9.97939 4.68668 16.4703 12.4081 9.88575 8.58427 numMergedOcc 0
17 mol 289 unq 0 iso 0 dist 8.71214 8.17436 7.67746 9.08224 9.97939 4.68668 16.4703 12.4081 9.88575 8.58427 numMergedOcc 0
