0 mol 8 unq 0 iso 0 dist 7.45487 5.43751 9.62879 9.49106 8.4069 8.96553 7.07501 7.18019 4.36226 8.53529 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 9.90845 9.59761 8.86116 10.6042 10.0952 6.86014 12.1924 12.9284 4.32034 7.33768 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 9.90845 9.59761 8.86116 10.6042 10.0952 6.86014 17.5266 13.4393 8.67951 9.01567 numMergedOcc 0
3 mol 24 unq 2 iso 0 dist 9.90845 9.59761 8.86116 10.6042 10.0952 6.86014 14.9821 8.60554 8.52463 7.29868 numMergedOcc 0
4 mol 58 unq 0 iso 0 dist 7.84983 11.5882 6.62496 12.9335 5.30792 6.86465 6.64072 5.93884 5.78774 9.92355 numMergedOcc 0
5 mol 58 unq 1 iso 0 dist 7.84983 11.5882 6.62496 9.56737 4.81926 6.35756 6.64072 5.93884 5.78774 7.68678 numMergedOcc 0
6 mol 58 unq 2 iso 0 dist 9.56737 11.5882 6.35756 12.9335 5.35073 6.86465 6.64072 7.68678 5.78774 9.92355 numMergedOcc 0
7 mol 58 unq 3 iso 0 dist 9.56737 11.5882 6.35756 7.84983 4.81926 6.62496 6.64072 7.68678 5.78774 5.93884 numMergedOcc 0
8 mol 60 unq 0 iso 0 dist 5.83937 9.96073 6.43294 11.1212 5.67502 8.7531 15.0068 10.1323 7.04075 9.90939 numMergedOcc 0
9 mol 60 unq 1 iso 0 dist 8.82095 13.6099 6.43294 10.5768 5.67502 8.7531 13.1258 10.1323 7.04075 9.90939 numMergedOcc 0
10 mol 73 unq 0 iso 0 dist 9.68526 8.31041 9.38498 7.26679 15.7123 9.96396 11.2253 13.8696 5.11416 9.24757 numMergedOcc 0
11 mol 73 unq 1 iso 0 dist 9.72442 11.7069 9.38498 10.1503 15.7123 9.96396 14.5478 13.8696 5.11416 9.24757 numMergedOcc 0
12 mol 73 unq 2 iso 0 dist 9.30776 8.31041 9.75218 7.26679 12.016 9.96396 11.2253 13.0145 5.11416 9.24757 numMergedOcc 0
13 mol 115 unq 0 iso 0 dist 6.7225 5.39296 5.11551 10.2695 6.5838 7.11972 6.39438 6.92026 6.77806 5.88249 numMergedOcc 0
14 mol 133 unq 0 iso 0 dist 9.48243 11.6637 9.91388 11.0972 6.69554 9.52634 11.7748 9.97654 4.34568 6.66772 numMergedOcc 0
15 mol 133 unq 1 iso 0 dist 9.48243 11.6637 9.91388 14.1743 6.761 7.24514 11.7748 9.97654 4.34568 7.71248 numMergedOcc 0
16 mol 133 unq 2 iso 0 dist 6.11955 7.96098 6.80239 10.4171 7.81217 6.29155 4.7146 5.87634 4.54648 6.16242 numMergedOcc 0
17 mol 134 unq 0 iso 0 dist 7.78849 11.454 9.89303 11.4625 5.79898 6.54501 4.15314 5.83771 7.41674 7.80532 numMergedOcc 0
18 mol 156 unq 0 iso 0 dist 6.71202 5.70205 7.66148 10.0734 10.1658 8.94056 5.36066 11.1147 6.13574 9.4013 numMergedOcc 0
19 mol 156 unq 1 iso 0 dist 9.16591 9.27577 9.83699 13.6067 8.38403 7.44554 11.3928 10.3379 5.4555 9.44367 numMergedOcc 0
20 mol 156 unq 2 iso 0 dist 9.16591 9.27577 9.83699 13.6067 8.38403 7.44554 14.679 13.0431 11.9952 9.47433 numMergedOcc 0
21 mol 156 unq 3 iso 0 dist 9.16591 9.27577 9.83699 16.4964 11.2719 8.94056 11.3928 10.3379 5.4555 7.90267 numMergedOcc 0
22 mol 181 unq 0 iso 0 dist 7.44191 9.60754 8.03334 18.07 13.2049 9.1374 17.5304 16.082 8.91338 8.90963 numMergedOcc 0
23 mol 181 unq 1 iso 0 dist 6.00053 11.1879 8.03334 16.1735 13.2049 9.1374 17.3753 16.082 8.91338 8.90963 numMergedOcc 0
24 mol 227 unq 0 iso 0 dist 9.17826 14.9329 7.22101 13.0242 4.39704 7.09863 16.3489 7.43071 6.35849 6.02296 numMergedOcc 0
25 mol 227 unq 1 iso 0 dist 9.64299 7.69739 7.09863 12.7101 4.39704 7.22101 9.17153 6.02296 6.35849 7.43071 numMergedOcc 0
26 mol 227 unq 2 iso 0 dist 9.64299 7.69739 7.09863 12.7101 4.39704 7.22101 17.6816 9.74265 10.9607 5.41321 numMergedOcc 0
27 mol 231 unq 0 iso 0 dist 7.79865 5.3251 7.37839 6.14348 4.06055 8.40182 7.00432 6.98875 6.37275 6.54852 numMergedOcc 0
28 mol 231 unq 1 iso 0 dist 6.14348 5.3251 8.40182 7.79865 4.06055 7.37839 7.00432 6.54852 6.37275 6.98875 numMergedOcc 0
29 mol 259 unq 0 iso 0 dist 7.93997 14.8465 7.46176 13.8509 6.96053 7.88519 10.9643 7.08526 8.81835 7.98231 numMergedOcc 0
