0 mol 7 unq 0 iso 0 dist 9.25234 9.49232 16.0368 8.98901 7.48475 11.3411 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 7.32126 9.57343 6.09371 6.46901 4.32471 10.0786 numMergedOcc 0
2 mol 46 unq 1 iso 0 dist 7.32126 9.57343 6.09371 9.30547 4.19866 5.79552 numMergedOcc 0
3 mol 94 unq 0 iso 0 dist 5.4622 7.98923 6.43951 7.81363 12.8989 12.4809 numMergedOcc 0
4 mol 109 unq 0 iso 0 dist 5.55005 8.19835 6.51107 5.93206 4.72156 5.28557 numMergedOcc 0
5 mol 109 unq 1 iso 0 dist 5.55005 8.19835 6.51107 7.73529 3.90222 9.66892 numMergedOcc 0
6 mol 115 unq 0 iso 0 dist 9.47443 7.90905 10.7909 7.65299 15.8352 7.85305 numMergedOcc 0
7 mol 123 unq 0 iso 0 dist 8.98076 9.06373 10.0144 6.9952 10.461 4.81545 numMergedOcc 0
8 mol 123 unq 1 iso 0 dist 8.98076 9.06373 10.0144 9.30054 4.22065 11.2125 numMergedOcc 0
9 mol 141 unq 0 iso 0 dist 6.47392 8.49149 6.31753 8.47476 10.5086 14.125 numMergedOcc 0
10 mol 141 unq 1 iso 0 dist 6.47392 8.49149 6.31753 6.74947 8.78038 8.50106 numMergedOcc 0
11 mol 167 unq 0 iso 0 dist 9.15244 5.7126 12.6201 9.08229 4.74884 13.3242 numMergedOcc 0
12 mol 167 unq 1 iso 0 dist 9.15244 5.7126 12.6201 7.99057 6.44271 10.1682 numMergedOcc 0
13 mol 167 unq 2 iso 0 dist 8.08948 5.7126 5.7816 9.08229 14.6278 13.3242 numMergedOcc 0
14 mol 167 unq 3 iso 0 dist 8.08948 5.7126 5.7816 7.99057 7.06542 10.1682 numMergedOcc 0
15 mol 176 unq 0 iso 0 dist 9.37716 5.10299 4.72035 7.75061 10.6298 7.04396 numMergedOcc 0
16 mol 176 unq 1 iso 0 dist 9.37716 5.10299 4.72035 9.11609 5.41212 6.75076 numMergedOcc 0
17 mol 176 unq 2 iso 0 dist 9.37716 5.10299 4.72035 8.85187 8.19458 7.80317 numMergedOcc 0
18 mol 176 unq 3 iso 0 dist 9.37716 5.10299 4.72035 9.44083 14.6456 10.6032 numMergedOcc 0
19 mol 287 unq 0 iso 0 dist 7.19754 6.2587 10.5476 6.38338 4.88674 7.88871 numMergedOcc 0
20 mol 288 unq 0 iso 0 dist 7.19754 6.2587 10.5476 6.38338 4.88674 7.88871 numMergedOcc 0
21 mol 289 unq 0 iso 0 dist 7.19754 6.2587 10.5476 6.38338 4.88674 7.88871 numMergedOcc 0
22 mol 292 unq 0 iso 0 dist 6.18484 8.01956 4.70797 9.05047 6.40429 10.846 numMergedOcc 0
23 mol 292 unq 1 iso 0 dist 6.18484 8.01956 4.70797 7.24072 4.34283 9.02523 numMergedOcc 0
24 mol 292 unq 2 iso 0 dist 6.59906 8.76413 5.50967 7.60019 12.2904 10.9754 numMergedOcc 0
25 mol 292 unq 3 iso 0 dist 7.1839 8.76413 11.1934 7.60019 4.49811 10.9754 numMergedOcc 0
