0 mol 29 unq 0 iso 0 dist 6.73481 4.11543 5.94216 3.97609 6.04161 7.075 numMergedOcc 0
1 mol 33 unq 0 iso 0 dist 8.41842 8.68099 7.03174 11.8297 7.82815 9.74845 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 5.44077 6.90686 5.0553 4.89928 6.34215 4.03744 numMergedOcc 0
3 mol 68 unq 0 iso 0 dist 5.73908 9.10734 9.00217 10.6719 8.52421 6.8245 numMergedOcc 0
4 mol 152 unq 0 iso 0 dist 5.28423 6.73318 5.35463 5.27395 6.75471 3.90634 numMergedOcc 0
5 mol 173 unq 0 iso 0 dist 8.84813 8.53917 7.90789 5.21212 6.95244 3.40693 numMergedOcc 0
6 mol 173 unq 1 iso 0 dist 8.84813 8.53917 7.90789 11.2286 6.11224 5.49842 numMergedOcc 0
7 mol 173 unq 2 iso 0 dist 8.84813 9.00436 4.13397 5.21212 6.95244 6.40851 numMergedOcc 0
8 mol 173 unq 3 iso 0 dist 8.84813 9.00436 4.13397 11.2286 6.11224 3.39015 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 5.31333 10.9895 5.84716 9.03587 5.27578 4.4877 numMergedOcc 0
10 mol 186 unq 1 iso 0 dist 5.83898 7.19985 7.62128 10.2261 9.77333 10.8024 numMergedOcc 0
11 mol 205 unq 0 iso 0 dist 7.55333 6.87889 9.49617 3.69062 6.50586 8.16419 numMergedOcc 0
12 mol 205 unq 1 iso 0 dist 7.84215 14.1789 9.15508 10.0544 6.75579 5.19623 numMergedOcc 0
13 mol 205 unq 2 iso 0 dist 7.84215 12.6877 8.54088 10.0544 6.75579 3.45124 numMergedOcc 0
14 mol 205 unq 3 iso 0 dist 7.97183 9.70455 9.15508 6.96644 6.75579 5.19623 numMergedOcc 0
15 mol 205 unq 4 iso 0 dist 7.97183 10.3836 8.54088 6.96644 6.75579 3.45124 numMergedOcc 0
16 mol 215 unq 0 iso 0 dist 5.92204 3.87327 9.5295 3.522 8.28951 5.0858 numMergedOcc 0
17 mol 215 unq 1 iso 0 dist 7.16839 3.87327 9.27928 3.522 9.66981 5.0858 numMergedOcc 0
18 mol 220 unq 0 iso 0 dist 8.55805 8.78097 8.01243 5.06821 8.63649 7.98284 numMergedOcc 0
19 mol 220 unq 1 iso 0 dist 8.55805 16.8623 9.55264 5.06821 8.63649 15.7445 numMergedOcc 0
20 mol 272 unq 0 iso 0 dist 7.38085 6.82732 7.67597 3.7218 5.38409 4.97184 numMergedOcc 0
21 mol 286 unq 0 iso 0 dist 8.97304 6.58832 9.09717 9.05338 6.64391 9.05435 numMergedOcc 0
