0 mol 8 unq 0 iso 0 dist 8.73998 8.23769 15.9437 16.3437 9.59644 23.2215 numMergedOcc 0
1 mol 103 unq 0 iso 0 dist 8.70106 8.68825 13.2825 10.6064 7.52954 16.5924 numMergedOcc 0
2 mol 119 unq 0 iso 0 dist 8.54701 6.41992 4.8922 7.72465 9.00829 10.5795 numMergedOcc 0
3 mol 119 unq 1 iso 0 dist 8.54701 8.15125 10.7175 7.72465 9.00829 12.7029 numMergedOcc 0
4 mol 123 unq 0 iso 0 dist 7.63425 8.24275 7.32307 3.4208 8.56386 6.7201 numMergedOcc 0
5 mol 124 unq 0 iso 0 dist 6.31232 7.87439 10.5562 6.70976 9.7589 13.6617 numMergedOcc 0
6 mol 131 unq 0 iso 0 dist 8.95717 8.78173 4.43386 9.30741 9.09918 12.5712 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 4.46578 8.1716 6.95294 6.53566 5.9962 12.713 numMergedOcc 0
8 mol 133 unq 1 iso 0 dist 4.46578 8.1716 6.95294 4.77272 8.61448 8.9344 numMergedOcc 0
9 mol 168 unq 0 iso 0 dist 9.58783 8.75994 11.6512 9.46815 9.60268 16.5325 numMergedOcc 0
10 mol 168 unq 1 iso 0 dist 9.58783 8.75994 11.6512 5.35061 8.79954 13.0188 numMergedOcc 0
11 mol 168 unq 2 iso 0 dist 9.58783 6.80155 14.1838 9.46815 9.60268 16.0952 numMergedOcc 0
12 mol 168 unq 3 iso 0 dist 9.58783 6.80155 14.1838 5.35061 8.79954 12.018 numMergedOcc 0
13 mol 187 unq 0 iso 0 dist 5.26804 9.25461 8.43209 6.54244 5.82577 8.26654 numMergedOcc 0
14 mol 226 unq 0 iso 0 dist 7.6174 5.61473 7.32691 13.1272 7.54614 13.8638 numMergedOcc 0
15 mol 238 unq 0 iso 0 dist 7.00773 6.54661 5.32456 5.22428 8.93135 9.94175 numMergedOcc 0
16 mol 238 unq 1 iso 0 dist 7.00773 8.97261 6.26991 5.22428 8.93135 13.2376 numMergedOcc 0
17 mol 239 unq 0 iso 0 dist 4.70107 7.48307 6.62046 5.23612 8.04934 12.6585 numMergedOcc 0
18 mol 239 unq 1 iso 0 dist 4.70107 7.48307 6.62046 6.41922 5.9919 5.648 numMergedOcc 0
19 mol 283 unq 0 iso 0 dist 6.89455 6.87568 4.90822 10.1296 8.89292 11.8571 numMergedOcc 0
20 mol 283 unq 1 iso 0 dist 9.82337 6.87568 7.05375 10.1296 8.43009 11.8571 numMergedOcc 0
21 mol 283 unq 2 iso 0 dist 8.07626 6.50648 4.90822 9.38191 8.89292 11.8571 numMergedOcc 0
22 mol 283 unq 3 iso 0 dist 6.3448 6.50648 7.05375 9.38191 8.43009 11.8571 numMergedOcc 0
