%chk=000187109.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187109

0 1
O 0.191864 1.000883 0.278944
O -5.166251 2.897845 -0.270775
O 1.430361 2.730790 -0.490192
O 1.413185 -0.750321 -2.041543
O 0.676147 -2.175529 -0.443746
C -2.130405 0.907648 0.684336
C -2.311413 -0.473509 0.028273
C -3.425363 1.728789 0.770934
C -3.261396 -1.381531 0.818035
C -1.049053 1.712495 -0.054053
C -3.279830 -2.802512 0.235964
C -4.099255 1.973100 -0.578621
C -4.226253 -3.717028 1.010111
C 1.378457 1.615917 -0.029345
C 2.506779 0.712218 0.344775
C 2.529133 -0.648608 0.004633
C 3.572875 1.270050 1.064885
C 3.607051 -1.452895 0.397979
C 4.648445 0.465950 1.452018
C 4.663333 -0.893265 1.123085
C 1.428592 -1.292325 -0.775308
C 0.399733 -1.253729 -2.953240
H -1.762492 0.740324 1.733062
H -1.310807 -0.961976 -0.039398
H -2.666492 -0.367965 -1.011916
H -4.145467 1.220612 1.446380
H -3.234349 2.708908 1.257587
H -4.284654 -0.960330 0.817052
H -2.950970 -1.420824 1.880455
H -0.960470 2.754453 0.298845
H -1.144230 1.697698 -1.150770
H -3.577022 -2.771757 -0.829627
H -2.253774 -3.224936 0.251331
H -4.531312 1.051757 -1.005900
H -3.426486 2.450651 -1.311653
H -5.256763 -3.345752 0.988616
H -3.930696 -3.803805 2.062105
H -4.231374 -4.728278 0.588304
H -5.726647 3.038614 -1.054685
H 3.560822 2.334225 1.314298
H 3.618289 -2.514384 0.142438
H 5.477165 0.901724 2.011514
H 5.501119 -1.520380 1.430886
H 0.647037 -0.737634 -3.887592
H -0.591151 -0.977310 -2.580363
H 0.491188 -2.340371 -3.048520


%chk=000187109-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000187109

0 1
O 0.244594 0.930164 0.301721
O -5.307965 2.829097 -0.273977
O 1.468830 2.791035 -0.395088
O 1.235759 -0.650398 -1.899050
O 1.290566 -2.579871 -0.593368
C -2.155271 0.888725 0.745219
C -2.330689 -0.512199 0.099258
C -3.454384 1.741668 0.792335
C -3.390788 -1.407352 0.778418
C -1.024583 1.680396 0.067874
C -3.422552 -2.836947 0.190089
C -4.089825 2.052719 -0.568932
C -4.477218 -3.741525 0.862994
C 1.426195 1.596462 -0.015613
C 2.623642 0.741343 0.270684
C 2.679989 -0.656521 0.006725
C 3.719476 1.374630 0.906266
C 3.796845 -1.405881 0.451889
C 4.841068 0.626012 1.320915
C 4.870935 -0.771929 1.111029
C 1.657991 -1.398247 -0.799132
C 0.269502 -1.325125 -2.797356
H -1.842104 0.731676 1.798606
H -1.353065 -1.030489 0.137939
H -2.584721 -0.397701 -0.977206
H -4.212807 1.223099 1.405928
H -3.246671 2.703940 1.299429
H -4.398923 -0.954926 0.682343
H -3.177199 -1.466259 1.866279
H -0.915585 2.695437 0.492364
H -1.160812 1.771608 -1.026755
H -3.627240 -2.777667 -0.899272
H -2.417688 -3.294209 0.293069
H -4.347156 1.114335 -1.104732
H -3.397139 2.644196 -1.205808
H -5.494479 -3.321841 0.746221
H -4.278640 -3.840879 1.946821
H -4.477741 -4.756944 0.425969
H -5.758869 3.072112 -1.121543
H 3.669166 2.453984 1.081220
H 3.814218 -2.483293 0.259124
H 5.679020 1.127739 1.816052
H 5.730363 -1.362190 1.445723
H 0.110726 -0.614176 -3.620181
H -0.669987 -1.531573 -2.258299
H 0.692415 -2.274540 -3.166594


