%chk=000213552.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213552

0 1
O -0.425632 0.370048 -1.396034
O 1.274712 -1.214745 0.995913
O -0.111698 -3.185469 -1.322610
N 2.388738 0.329240 -0.252463
N -1.682211 -1.896665 -0.297615
C 0.373329 -0.815377 -1.209946
C 1.371230 -0.588778 -0.047852
C 3.378928 0.553809 0.840739
C 2.522835 1.161836 -1.475544
C -0.457065 -2.083466 -0.954614
C -1.480423 0.524476 -0.497119
C -2.141670 -0.599374 0.057748
C 3.009234 1.762729 1.696110
C 3.338264 0.446208 -2.550769
C -1.898332 1.828255 -0.236372
C -3.237422 -0.390566 0.905560
C -3.005524 2.014442 0.599650
C -3.661843 0.917488 1.166081
H 0.890815 -0.905061 -2.199262
H 3.414702 -0.365120 1.478600
H 4.385895 0.679326 0.387411
H 1.510377 1.431983 -1.861082
H 3.010422 2.125624 -1.202528
H -2.214254 -2.713239 0.005226
H 2.971290 2.690530 1.116110
H 2.023487 1.629866 2.164606
H 3.735177 1.904528 2.505458
H 4.347564 0.197224 -2.199255
H 2.873472 -0.496480 -2.865483
H 3.445967 1.073108 -3.443988
H -1.372504 2.669907 -0.682085
H -3.755858 -1.234378 1.357066
H -3.352051 3.024979 0.812425
H -4.517052 1.078915 1.822219


%chk=000213552-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000213552

0 1
O -0.525257 0.483525 -1.437659
O 1.134276 -1.095757 1.022646
O -0.084130 -3.135871 -1.421083
N 2.392315 0.334382 -0.323645
N -1.670111 -1.817436 -0.330758
C 0.331115 -0.727048 -1.266980
C 1.328561 -0.515717 -0.093124
C 3.341385 0.576395 0.793467
C 2.632544 1.057502 -1.596965
C -0.484871 -2.008580 -1.023331
C -1.558492 0.611084 -0.478194
C -2.149995 -0.550623 0.084373
C 2.910754 1.764021 1.679673
C 3.611510 0.317761 -2.535131
C -2.035015 1.893280 -0.157869
C -3.223491 -0.410018 0.991344
C -3.117849 2.026745 0.741848
C -3.706863 0.876432 1.317283
H 0.844298 -0.840692 -2.233241
H 3.385175 -0.343697 1.400205
H 4.341085 0.754340 0.355505
H 1.669528 1.245350 -2.098619
H 3.043251 2.052102 -1.338779
H -2.184463 -2.661432 -0.064832
H 2.828459 2.698264 1.094177
H 1.933129 1.554280 2.145534
H 3.650595 1.928108 2.484264
H 4.586900 0.149598 -2.044382
H 3.211935 -0.667624 -2.834548
H 3.786954 0.911891 -3.450619
H -1.560107 2.765557 -0.617093
H -3.677205 -1.302501 1.438302
H -3.493232 3.023532 0.994294
H -4.539790 0.978651 2.020239


