0 mol 7 unq 0 iso 0 dist 5.77374 9.8603 5.70161 9.30196 6.0323 7.15434 16.6461 11.2505 9.67164 8.75346 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.57437 9.8603 4.57188 9.30196 10.2084 7.15434 16.6461 13.158 9.67164 8.75346 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 6.76332 8.46229 5.41626 6.21955 10.1248 9.16444 3.96333 5.18338 8.30653 6.92407 numMergedOcc 0
3 mol 30 unq 0 iso 0 dist 8.64082 8.609 7.18789 4.64354 10.5288 6.83481 3.65941 5.36413 6.74179 6.01658 numMergedOcc 0
4 mol 56 unq 0 iso 0 dist 9.52763 7.20538 7.91078 8.39913 12.7012 8.96238 7.2452 14.3034 9.03564 12.9131 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 5.58346 6.18305 5.2774 12.2435 7.84699 8.124 4.21749 9.71578 8.68662 15.7072 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 5.58346 6.18305 5.2774 12.2435 7.84699 8.124 5.65986 10.1662 7.4369 15.2252 numMergedOcc 0
7 mol 73 unq 2 iso 0 dist 9.10386 6.18305 5.44275 12.2435 8.40844 8.124 4.21749 12.3622 8.68662 15.7072 numMergedOcc 0
8 mol 73 unq 3 iso 0 dist 9.10386 6.18305 5.44275 12.2435 8.40844 8.124 5.65986 11.4233 7.4369 15.2252 numMergedOcc 0
9 mol 86 unq 0 iso 0 dist 7.91639 8.88225 10.9597 11.0165 16.2055 8.40609 6.62266 13.0906 7.90423 4.74546 numMergedOcc 0
10 mol 119 unq 0 iso 0 dist 9.44788 5.63005 12.1168 11.5865 18.7603 8.62648 5.92411 14.5277 7.64052 12.6962 numMergedOcc 0
11 mol 139 unq 0 iso 0 dist 8.27507 6.34417 10.3273 7.80874 15.5229 8.32294 4.37138 9.07404 5.80789 7.14578 numMergedOcc 0
12 mol 181 unq 0 iso 0 dist 6.13872 9.58911 5.07895 7.56512 8.03259 6.58792 17.3349 13.418 8.59874 11.9701 numMergedOcc 0
13 mol 218 unq 0 iso 0 dist 6.2441 6.9398 8.31343 6.7488 5.98076 4.851 3.5359 8.38813 6.67404 6.13691 numMergedOcc 0
