0 mol 1 unq 0 iso 0 dist 9.40282 7.48521 6.86701 13.8284 7.29854 7.68226 11.8064 11.3766 5.21705 8.61411 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 6.84521 6.59001 6.66407 10.2097 12.1132 8.03914 14.0805 15.1614 8.8955 7.75667 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 5.9651 4.60844 9.8703 6.37408 8.66168 6.37273 9.04231 14.0352 6.56256 6.88786 numMergedOcc 0
3 mol 89 unq 0 iso 0 dist 8.56124 4.56271 6.53308 11.7854 10.5385 8.68698 9.59334 13.2721 9.35696 7.24906 numMergedOcc 0
4 mol 139 unq 0 iso 0 dist 5.11962 5.21231 5.80789 12.2917 10.3273 9.07404 4.71927 6.34417 4.37138 8.27507 numMergedOcc 0
5 mol 139 unq 1 iso 0 dist 5.11962 5.21231 5.80789 12.2917 10.3273 9.07404 11.6361 13.5702 11.247 9.99665 numMergedOcc 0
6 mol 162 unq 0 iso 0 dist 5.21803 4.6728 7.37333 11.6794 8.35998 9.95076 16.7318 15.3517 13.5522 8.77869 numMergedOcc 0
7 mol 162 unq 1 iso 0 dist 5.21803 7.06734 7.45998 11.6794 8.35998 7.76112 16.7318 15.3517 12.6287 8.77869 numMergedOcc 0
8 mol 186 unq 0 iso 0 dist 8.77347 8.69152 6.61112 14.5916 10.568 9.82338 12.2086 9.44405 3.6848 9.71223 numMergedOcc 0
9 mol 218 unq 0 iso 0 dist 9.79816 15.4347 7.33709 21.3574 12.0573 8.38813 16.0359 7.73315 3.5359 6.2441 numMergedOcc 0
10 mol 243 unq 0 iso 0 dist 7.80612 8.97902 8.67156 11.5301 12.7467 7.89993 15.6276 16.0615 7.64134 8.89116 numMergedOcc 0
11 mol 243 unq 1 iso 0 dist 7.80612 8.97902 8.67156 11.5301 12.7467 7.89993 18.0359 16.5515 10.4256 8.28364 numMergedOcc 0
12 mol 273 unq 0 iso 0 dist 9.79022 4.3735 6.31969 8.24507 9.45651 5.63226 13.9951 16.1263 13.255 8.78928 numMergedOcc 0
