0 mol 32 unq 0 iso 0 dist 8.89682 11.483 8.34024 14.3209 9.05087 7.11053 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 6.17472 8.02212 8.82122 13.7255 13.8687 5.91068 numMergedOcc 0
2 mol 98 unq 0 iso 0 dist 7.26246 8.13159 7.42204 10.0801 6.29596 5.81771 numMergedOcc 0
3 mol 98 unq 1 iso 0 dist 8.6728 5.54452 7.42204 8.75195 6.29596 5.81771 numMergedOcc 0
4 mol 112 unq 0 iso 0 dist 9.17909 5.46082 7.12413 13.2055 9.71348 8.91262 numMergedOcc 0
5 mol 112 unq 1 iso 0 dist 9.17909 5.46082 7.12413 10.9702 5.96497 6.12922 numMergedOcc 0
6 mol 112 unq 2 iso 0 dist 9.37708 10.9659 7.12413 12.3351 9.71348 8.91262 numMergedOcc 0
7 mol 112 unq 3 iso 0 dist 9.37708 10.9659 7.12413 7.77418 5.96497 6.12922 numMergedOcc 0
8 mol 134 unq 0 iso 0 dist 9.21999 6.63186 8.33489 6.41759 4.56331 5.52149 numMergedOcc 0
9 mol 135 unq 0 iso 0 dist 7.54797 4.51614 9.16513 10.1055 11.4806 9.09753 numMergedOcc 0
10 mol 135 unq 1 iso 0 dist 7.54797 4.51614 9.16513 9.13739 8.91766 7.6337 numMergedOcc 0
11 mol 148 unq 0 iso 0 dist 5.34451 9.8187 9.66935 14.9464 12.4577 8.42899 numMergedOcc 0
12 mol 150 unq 0 iso 0 dist 6.6175 9.6867 8.9891 14.8677 11.4342 8.33721 numMergedOcc 0
13 mol 173 unq 0 iso 0 dist 9.17063 9.61315 9.25763 8.51691 10.1842 8.62366 numMergedOcc 0
14 mol 173 unq 1 iso 0 dist 9.17063 9.61315 9.25763 13.9069 12.4786 9.44973 numMergedOcc 0
15 mol 173 unq 2 iso 0 dist 9.17063 9.61315 9.25763 12.2122 13.8624 6.52508 numMergedOcc 0
16 mol 173 unq 3 iso 0 dist 9.99332 9.61315 9.63102 8.51691 7.24163 8.62366 numMergedOcc 0
17 mol 173 unq 4 iso 0 dist 9.99332 9.61315 9.63102 13.9069 8.98989 9.44973 numMergedOcc 0
18 mol 173 unq 5 iso 0 dist 9.99332 9.61315 9.63102 12.2122 12.0865 6.52508 numMergedOcc 0
19 mol 175 unq 0 iso 0 dist 7.2067 4.18777 6.84347 10.9268 9.36968 9.76114 numMergedOcc 0
20 mol 214 unq 0 iso 0 dist 5.69733 5.24956 6.35728 6.91906 4.112 8.70987 numMergedOcc 0
21 mol 220 unq 0 iso 0 dist 9.41713 9.60989 9.55672 14.0444 7.1165 8.09249 numMergedOcc 0
22 mol 227 unq 0 iso 0 dist 7.99145 10.2228 8.34104 15.5568 15.7465 7.79951 numMergedOcc 0
23 mol 234 unq 0 iso 0 dist 8.8978 12.7871 8.79054 18.7334 12.7385 7.20293 numMergedOcc 0
24 mol 274 unq 0 iso 0 dist 5.68643 9.3038 9.36111 16.7014 14.2747 8.69686 numMergedOcc 0
25 mol 274 unq 1 iso 0 dist 8.36043 9.3038 6.75233 16.7014 9.69088 8.69686 numMergedOcc 0
26 mol 274 unq 2 iso 0 dist 7.24089 5.06637 5.42845 10.4698 5.9397 6.66172 numMergedOcc 0
27 mol 274 unq 3 iso 0 dist 9.96645 6.13137 5.12523 14.2821 4.43818 9.23897 numMergedOcc 0
28 mol 274 unq 4 iso 0 dist 9.29005 5.18671 5.42845 11.135 5.9397 6.66172 numMergedOcc 0
29 mol 274 unq 5 iso 0 dist 8.16746 5.18671 5.62484 11.135 4.89003 6.66172 numMergedOcc 0
30 mol 274 unq 6 iso 0 dist 9.2447 5.06306 5.12523 12.4094 4.43818 9.23897 numMergedOcc 0
31 mol 283 unq 0 iso 0 dist 6.15136 6.66242 8.30268 14.0629 11.7594 8.51504 numMergedOcc 0
32 mol 284 unq 0 iso 0 dist 7.80784 9.26331 9.1161 9.02411 6.34668 9.69262 numMergedOcc 0
