0 mol 24 unq 0 iso 0 dist 5.02954 4.82556 5.9372 7.19293 9.58192 11.6859 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 5.02954 6.25108 6.93597 7.19293 9.58192 11.076 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 7.05619 4.20245 5.82264 5.49377 7.7927 5.50677 numMergedOcc 0
3 mol 48 unq 1 iso 0 dist 7.05619 4.20245 5.82264 6.47829 6.17378 3.90503 numMergedOcc 0
4 mol 48 unq 2 iso 0 dist 7.05619 14.3081 8.56365 5.49377 7.7927 11.8248 numMergedOcc 0
5 mol 48 unq 3 iso 0 dist 7.05619 14.3081 8.56365 6.47829 6.17378 9.10288 numMergedOcc 0
6 mol 54 unq 0 iso 0 dist 5.85153 10.6977 8.75957 10.0644 9.41463 10.0092 numMergedOcc 0
7 mol 62 unq 0 iso 0 dist 9.71949 7.97193 8.21895 6.35287 9.19512 4.09232 numMergedOcc 0
8 mol 93 unq 0 iso 0 dist 9.30843 14.0508 7.48947 4.97727 8.28591 14.433 numMergedOcc 0
9 mol 93 unq 1 iso 0 dist 9.30843 14.0508 7.48947 5.77343 5.35008 9.54244 numMergedOcc 0
10 mol 93 unq 2 iso 0 dist 9.30843 14.0508 7.48947 11.0802 8.30921 9.86691 numMergedOcc 0
11 mol 93 unq 3 iso 0 dist 6.25522 5.25485 7.48947 13.8087 8.28591 14.433 numMergedOcc 0
12 mol 93 unq 4 iso 0 dist 6.25522 5.25485 7.48947 9.96831 5.35008 9.54244 numMergedOcc 0
13 mol 93 unq 5 iso 0 dist 6.25522 5.25485 7.48947 5.33894 8.30921 9.86691 numMergedOcc 0
14 mol 113 unq 0 iso 0 dist 8.28325 7.76807 5.35711 7.48733 4.30875 3.84573 numMergedOcc 0
15 mol 119 unq 0 iso 0 dist 8.34342 7.34151 6.21165 9.75037 4.55071 10.3622 numMergedOcc 0
16 mol 119 unq 1 iso 0 dist 7.62197 11.7884 6.21165 6.71103 4.55071 10.3622 numMergedOcc 0
17 mol 119 unq 2 iso 0 dist 9.31621 5.93976 6.21165 12.6399 4.55071 10.3622 numMergedOcc 0
18 mol 131 unq 0 iso 0 dist 4.48699 5.67023 8.47526 4.24991 8.49847 6.11089 numMergedOcc 0
19 mol 141 unq 0 iso 0 dist 5.4206 12.612 8.40695 5.56306 7.56563 11.0215 numMergedOcc 0
20 mol 143 unq 0 iso 0 dist 7.22 5.99865 7.2932 6.16103 6.60366 4.06908 numMergedOcc 0
21 mol 158 unq 0 iso 0 dist 8.06621 10.3886 4.6512 12.4672 6.77583 4.09908 numMergedOcc 0
22 mol 158 unq 1 iso 0 dist 8.06621 10.8263 9.45696 12.4672 6.77583 9.81176 numMergedOcc 0
23 mol 169 unq 0 iso 0 dist 8.21203 7.77054 5.41121 7.59743 4.11374 3.95773 numMergedOcc 0
24 mol 186 unq 0 iso 0 dist 9.12783 6.16503 5.68985 12.0756 7.36794 8.66149 numMergedOcc 0
25 mol 186 unq 1 iso 0 dist 9.12783 6.16503 5.68985 9.57029 5.81881 3.87169 numMergedOcc 0
26 mol 186 unq 2 iso 0 dist 8.46395 5.81211 5.25762 12.8784 9.34653 12.7314 numMergedOcc 0
27 mol 186 unq 3 iso 0 dist 6.08596 8.11873 5.25762 8.88593 9.34653 12.7314 numMergedOcc 0
28 mol 214 unq 0 iso 0 dist 6.20118 4.23527 5.05626 6.28124 8.49349 3.94038 numMergedOcc 0
