%chk=000237341.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000237341

0 1
O 1.640706 1.970662 1.491010
O 0.906365 0.290649 -1.568972
O -0.340319 3.244625 0.734551
O 0.855134 -1.706825 0.807235
O 3.767001 0.121681 1.300359
N -1.928489 0.054465 -0.279447
N -2.403213 -1.704625 -3.169387
C 0.773996 1.092403 0.759532
C 1.594256 0.348335 -0.322831
C -0.394563 1.928994 0.182724
C 1.965572 -1.085260 0.127165
C -1.772671 1.314000 0.515746
C 3.092938 -1.127744 1.181264
C -2.699824 0.321093 -1.541432
C -2.570849 -1.022113 0.529523
C -2.532260 -0.811520 -2.449042
H 0.433778 0.381016 1.555153
H 2.524713 0.917785 -0.582473
H -0.275177 2.116500 -0.913208
H 2.214429 -1.698561 -0.768666
H -2.560122 2.074615 0.318907
H -1.839277 1.107610 1.606122
H 3.900160 -1.821736 0.878561
H 2.683216 -1.441680 2.161932
H 1.914948 2.738791 0.926213
H 0.045591 -0.189699 -1.477636
H -0.188310 3.214698 1.711104
H -2.287643 1.244569 -2.028676
H -3.789561 0.509421 -1.373183
H -1.914839 -1.264109 1.385411
H -2.661495 -1.940045 -0.076480
H -3.569851 -0.777016 0.920392
H 0.098734 -1.820436 0.192186
H 3.191826 0.787156 1.771743


%chk=000237341-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000237341

0 1
O 1.934851 2.249146 0.978821
O 0.497674 -0.252034 -1.338043
O -0.596321 3.071890 1.227737
O 0.941114 -1.955049 0.819826
O 3.918240 0.216341 1.358000
N -1.935414 -0.014401 -0.392200
N -2.977453 -1.207700 -3.551039
C 0.900958 1.192164 0.706885
C 1.462776 0.169885 -0.329967
C -0.427970 1.912447 0.343014
C 2.051365 -1.107543 0.342633
C -1.685968 1.057483 0.626316
C 2.956925 -0.868219 1.569853
C -2.716955 0.531853 -1.545631
C -2.560791 -1.231929 0.201468
C -2.846280 -0.436652 -2.651619
H 0.766133 0.726112 1.698863
H 2.282822 0.667987 -0.886191
H -0.395335 2.244577 -0.717940
H 2.615541 -1.638848 -0.450277
H -2.547304 1.752511 0.703052
H -1.565222 0.579600 1.613552
H 3.560381 -1.769961 1.758335
H 2.320602 -0.693529 2.463233
H 2.252589 2.610229 0.108672
H -0.476960 -0.270837 -0.950356
H 0.320651 3.375440 1.476568
H -2.199749 1.431438 -1.925787
H -3.739247 0.840929 -1.229992
H -1.883039 -1.631278 0.974215
H -2.691760 -1.998561 -0.580701
H -3.549811 -1.018434 0.659778
H 0.459347 -2.251779 0.003182
H 3.428511 1.084420 1.421143


