%chk=000234688.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000234688

0 1
O -0.435250 0.986750 -0.312525
O -0.792157 -1.266692 0.215285
C 1.518575 -0.405513 0.209344
C 0.966865 0.782247 -0.636388
C -1.309434 -0.131259 -0.496689
C 0.578436 -1.611754 -0.053037
C 1.512686 -0.076391 1.704517
C 2.932867 -0.767249 -0.262657
C -2.624444 0.238151 0.211737
C 1.587991 2.139612 -0.342637
C -1.490980 -0.453124 -1.980179
C -2.414303 0.556519 1.687567
H 1.031209 0.541926 -1.721412
H 0.658495 -1.990463 -1.085048
H 0.749336 -2.439778 0.657685
H 2.185863 0.750495 1.946890
H 0.495795 0.214714 2.013782
H 1.808962 -0.936056 2.312675
H 3.319101 -1.641489 0.274093
H 2.970226 -0.994156 -1.332728
H 3.635174 0.053757 -0.076655
H -3.334177 -0.605477 0.101725
H -3.071107 1.110195 -0.305519
H 2.680598 2.103342 -0.372344
H 1.243787 2.889929 -1.065273
H 1.280883 2.502130 0.649043
H -0.545493 -0.706156 -2.469140
H -2.163915 -1.307570 -2.114107
H -1.913066 0.404342 -2.516323
H -1.978971 -0.305380 2.212123
H -1.714001 1.394918 1.806972
H -3.354550 0.820182 2.179622


%chk=000234688-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000234688

0 1
O -0.451057 1.032763 -0.287191
O -0.805397 -1.306481 0.252700
C 1.540536 -0.393920 0.232940
C 0.980467 0.801054 -0.609195
C -1.333253 -0.133862 -0.476139
C 0.602977 -1.601573 -0.053553
C 1.549344 -0.081304 1.747381
C 2.961429 -0.768387 -0.255690
C -2.667007 0.223716 0.204954
C 1.656945 2.157068 -0.391226
C -1.523259 -0.453604 -1.974988
C -2.536098 0.563139 1.702031
H 1.070384 0.519488 -1.684351
H 0.714253 -1.921466 -1.113601
H 0.854604 -2.457103 0.597173
H 2.243133 0.745201 1.984450
H 0.539909 0.196767 2.093513
H 1.878317 -0.969484 2.319202
H 3.303464 -1.703584 0.227142
H 2.989805 -0.924085 -1.351817
H 3.692547 0.020241 -0.003804
H -3.348322 -0.637228 0.067537
H -3.100746 1.080712 -0.344355
H 2.739973 2.101408 -0.598580
H 1.211573 2.906966 -1.067398
H 1.508384 2.505709 0.644464
H -0.579954 -0.727054 -2.477264
H -2.225596 -1.297502 -2.085826
H -1.940692 0.428797 -2.489849
H -2.111558 -0.291620 2.255406
H -1.874032 1.434042 1.844343
H -3.526072 0.801888 2.131989


