0 mol 21 unq 0 iso 0 dist 9.36951 10.3306 8.7443 17.1331 9.9805 8.73484 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 6.84355 4.30555 5.11382 6.44893 10.4706 9.65174 numMergedOcc 0
2 mol 30 unq 0 iso 0 dist 8.02713 7.69013 9.39194 6.40398 5.24517 7.78893 numMergedOcc 0
3 mol 30 unq 1 iso 0 dist 8.02713 11.7275 7.30322 6.40398 5.24517 5.85146 numMergedOcc 0
4 mol 74 unq 0 iso 0 dist 9.46313 4.49883 8.4902 5.50438 7.42971 8.42173 numMergedOcc 0
5 mol 74 unq 1 iso 0 dist 7.81632 4.49883 8.30395 5.50438 7.00308 8.42173 numMergedOcc 0
6 mol 74 unq 2 iso 0 dist 6.50183 6.34189 8.30395 8.97568 7.00308 8.42173 numMergedOcc 0
7 mol 141 unq 0 iso 0 dist 8.52784 13.8223 8.14978 10.9559 5.44816 8.88454 numMergedOcc 0
8 mol 141 unq 1 iso 0 dist 8.52784 13.8223 8.14978 15.5617 9.06521 9.48581 numMergedOcc 0
9 mol 167 unq 0 iso 0 dist 9.33818 5.60897 8.0697 6.6276 7.2128 8.23119 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 8.30192 6.7472 6.91764 10.4646 6.63507 9.12783 numMergedOcc 0
11 mol 205 unq 0 iso 0 dist 9.63592 8.6637 6.2669 10.3942 10.0849 5.19567 numMergedOcc 0
12 mol 205 unq 1 iso 0 dist 5.64116 7.82495 6.2669 10.4442 10.0849 5.19567 numMergedOcc 0
13 mol 218 unq 0 iso 0 dist 7.78107 14.6059 9.08818 16.3253 12.5087 8.98941 numMergedOcc 0
14 mol 218 unq 1 iso 0 dist 7.78107 14.6059 9.08818 16.2729 9.82261 5.4621 numMergedOcc 0
15 mol 218 unq 2 iso 0 dist 6.89237 15.2501 9.08818 18.4616 12.5087 8.98941 numMergedOcc 0
16 mol 218 unq 3 iso 0 dist 6.89237 15.2501 9.08818 16.6887 9.82261 5.4621 numMergedOcc 0
17 mol 230 unq 0 iso 0 dist 8.27047 7.72583 9.64987 6.47064 5.33482 7.83105 numMergedOcc 0
18 mol 230 unq 1 iso 0 dist 8.27047 11.7343 7.12149 6.47064 5.33482 5.63025 numMergedOcc 0
19 mol 252 unq 0 iso 0 dist 6.87259 4.20436 5.2116 12.4611 9.34602 8.38453 numMergedOcc 0
20 mol 252 unq 1 iso 0 dist 6.31608 5.45887 5.2116 9.45457 9.34602 8.38453 numMergedOcc 0
