%chk=000272912.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000272912

0 1
O 3.868674 1.294151 1.754590
O 1.480885 0.610215 -2.151083
O 0.571102 3.216798 1.289197
O -4.734498 -2.294752 1.235436
O -3.229782 -3.364280 -0.064474
N 2.586708 1.283305 -0.206191
N -1.567531 2.903693 -0.603265
C 2.312576 2.724002 -0.280062
C 3.322860 -0.793061 0.555599
C 2.602822 -0.999893 -0.656721
C -0.148754 3.023790 -1.008823
C 3.347868 0.673180 0.871191
C 2.121386 0.322858 -1.169917
C 0.855334 3.003393 0.139283
C -2.041674 1.609015 -0.269491
C 3.865696 -1.850014 1.252180
C 2.423387 -2.263744 -1.174567
C -2.034597 4.054426 0.216428
C 3.683016 -3.150937 0.721624
C 2.980766 -3.352440 -0.459700
C -1.509250 0.475653 -0.938380
C -3.125709 1.427945 0.624935
C -2.044152 -0.783508 -0.718276
C -3.652790 0.160178 0.837980
C -3.117259 -0.958416 0.177173
C -3.636277 -2.315502 0.389978
C -5.338949 -3.579924 1.533321
H 3.001962 3.262222 0.421455
H 2.522604 3.102365 -1.305357
H 0.094996 2.210289 -1.750842
H -0.024010 3.974550 -1.581163
H 4.415353 -1.698255 2.182570
H 1.869078 -2.428687 -2.100109
H -1.623545 4.047027 1.243736
H -3.136711 4.050774 0.269488
H -1.737261 4.998032 -0.268333
H 4.102401 -4.003016 1.260386
H 2.845645 -4.363213 -0.850603
H -0.691257 0.594126 -1.654393
H -3.552484 2.274236 1.157765
H -1.637681 -1.655890 -1.239090
H -4.488732 0.021820 1.530770
H -4.632260 -4.187706 2.106483
H -5.615045 -4.085915 0.602373
H -6.216011 -3.300291 2.125099


%chk=000272912-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000272912

0 1
O 4.865318 1.971271 0.471175
O 1.319612 -0.463259 -1.424025
O 0.810950 1.844476 1.227955
O -6.095480 -1.861247 0.883459
O -4.575517 -3.127480 -0.352988
N 2.935473 1.030461 -0.552076
N -1.638590 2.710722 0.022618
C 2.169460 2.250058 -0.767851
C 4.554503 -0.485622 0.141080
C 3.489735 -1.222885 -0.437997
C -0.392682 2.742371 -0.724039
C 4.214773 0.971896 0.083776
C 2.434258 -0.260425 -0.877623
C 0.846006 2.233011 0.040318
C -2.415699 1.543970 0.083794
C 5.691899 -1.125436 0.654096
C 3.528630 -2.622197 -0.521881
C -1.972515 3.867214 0.868676
C 5.740906 -2.542112 0.573226
C 4.676467 -3.278514 -0.005174
C -1.991981 0.320807 -0.531593
C -3.677257 1.553513 0.761445
C -2.809993 -0.816263 -0.488437
C -4.483544 0.406332 0.799629
C -4.069297 -0.796941 0.169924
C -4.883397 -2.030155 0.183432
C -6.958931 -3.058849 0.935441
H 2.796806 3.091186 -0.412956
H 1.962648 2.390790 -1.844611
H -0.474697 2.146888 -1.654778
H -0.178999 3.779980 -1.055685
H 6.506393 -0.547619 1.101632
H 2.699531 -3.181453 -0.966120
H -2.026878 3.582143 1.936667
H -2.938086 4.324160 0.574915
H -1.188652 4.634719 0.765604
H 6.612370 -3.076828 0.965504
H 4.741473 -4.370688 -0.050677
H -1.011190 0.231351 -1.007450
H -4.031803 2.462743 1.254048
H -2.477879 -1.749984 -0.954418
H -5.446837 0.430264 1.317098
H -6.434388 -3.892229 1.433570
H -7.242758 -3.375570 -0.082896
H -7.841261 -2.745969 1.512397


