0 mol 4 unq 0 iso 0 dist 6.10734 12.7044 8.24634 15.6929 10.6506 9.16617 numMergedOcc 0
1 mol 4 unq 1 iso 0 dist 6.10734 12.7044 8.24634 17.7704 11.7391 8.87255 numMergedOcc 0
2 mol 7 unq 0 iso 0 dist 9.02286 14.1047 6.44736 13.0802 6.14349 6.7985 numMergedOcc 0
3 mol 25 unq 0 iso 0 dist 8.00738 4.96681 7.92503 10.2461 12.7398 6.16347 numMergedOcc 0
4 mol 68 unq 0 iso 0 dist 8.38855 8.36943 7.26024 12.5354 6.00618 6.36086 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 6.48163 11.5195 5.9465 15.7302 9.38827 8.18107 numMergedOcc 0
6 mol 92 unq 1 iso 0 dist 6.48163 11.5567 6.97962 15.7302 9.38827 9.8859 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 9.57532 12.1367 9.23858 17.299 12.3703 6.52773 numMergedOcc 0
8 mol 119 unq 1 iso 0 dist 8.61574 10.5726 9.23858 14.0057 12.3703 6.52773 numMergedOcc 0
9 mol 130 unq 0 iso 0 dist 6.87196 10.6181 7.90048 17.1 12.2217 9.99802 numMergedOcc 0
10 mol 131 unq 0 iso 0 dist 5.43662 5.29825 8.70296 13.3064 14.5627 9.25558 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 9.93309 10.4303 9.22232 16.8608 18.2432 9.22661 numMergedOcc 0
12 mol 133 unq 1 iso 0 dist 9.93309 10.4303 9.22232 11.0312 15.4484 7.56378 numMergedOcc 0
13 mol 156 unq 0 iso 0 dist 6.10069 9.92385 9.47433 18.8904 16.7026 9.44367 numMergedOcc 0
14 mol 156 unq 1 iso 0 dist 6.40435 11.0374 9.44367 18.8628 16.7026 9.47433 numMergedOcc 0
15 mol 181 unq 0 iso 0 dist 8.50938 5.32859 6.46704 9.8283 9.87773 6.59025 numMergedOcc 0
16 mol 212 unq 0 iso 0 dist 8.36471 9.83647 9.74144 17.1965 12.5482 8.69988 numMergedOcc 0
17 mol 212 unq 1 iso 0 dist 8.36471 9.83647 9.74144 17.427 15.0034 8.55903 numMergedOcc 0
18 mol 212 unq 2 iso 0 dist 8.36471 9.83647 9.74144 11.3524 5.24023 7.15603 numMergedOcc 0
19 mol 213 unq 0 iso 0 dist 8.76398 5.97098 7.37798 13.1204 13.2902 7.73322 numMergedOcc 0
20 mol 227 unq 0 iso 0 dist 6.65275 5.841 5.41321 11.6367 11.362 7.43071 numMergedOcc 0
21 mol 227 unq 1 iso 0 dist 9.90065 9.69354 7.43071 13.582 11.362 5.41321 numMergedOcc 0
