%chk=000233370.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000233370

0 1
O -4.822102 -0.505045 -1.305645
O 0.436661 -2.355660 0.434205
O -0.208100 2.111887 1.884633
O 1.376623 2.809779 -0.429857
N -2.518496 -0.107548 0.328745
C -2.565131 -1.213483 -0.681585
C -3.893832 0.173617 0.856822
C -1.570804 -0.421183 1.448264
C -3.506831 -0.790240 -1.821883
C -4.802346 0.552168 -0.324171
C -0.174120 -0.099429 0.997645
C 0.702040 -1.016810 0.519464
C 2.062296 -0.689658 0.046890
C 0.232314 1.318494 1.094141
C 2.385973 0.670740 -0.151500
C 1.357279 1.728604 0.097022
C 3.014263 -1.680583 -0.209472
C 3.657346 1.023191 -0.608509
C 4.291585 -1.316711 -0.656673
C 4.612663 0.027195 -0.854568
H -1.540197 -1.363907 -1.084657
H -2.910658 -2.179439 -0.255652
H -4.332351 -0.683787 1.409840
H -3.825849 1.030812 1.562877
H -1.816292 0.229605 2.326147
H -1.638918 -1.472648 1.809468
H -3.126618 0.099599 -2.355182
H -3.700745 -1.612624 -2.531734
H -5.863457 0.623915 -0.029184
H -4.471932 1.488295 -0.809303
H 2.755608 -2.731986 -0.062276
H 3.897294 2.077368 -0.775560
H 5.034885 -2.090836 -0.852119
H 5.606799 0.307030 -1.204913
H -0.476552 -2.575421 0.782881


%chk=000233370-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000233370

0 1
O -4.915738 -0.810112 -1.262836
O 0.368588 -2.261647 0.520407
O -0.474073 2.421594 1.382514
O 2.035221 3.031801 0.279256
N -2.604277 -0.061974 0.322116
C -2.513289 -1.118570 -0.709651
C -3.982192 0.050731 0.867172
C -1.593513 -0.199284 1.395712
C -3.555494 -0.880556 -1.815935
C -4.983205 0.281627 -0.275163
C -0.182577 0.083516 0.915407
C 0.700412 -0.908972 0.516518
C 2.072136 -0.652729 0.041564
C 0.253327 1.489342 0.924827
C 2.542849 0.692024 -0.040143
C 1.665879 1.829115 0.368229
C 2.923661 -1.715706 -0.346312
C 3.852424 0.952805 -0.508121
C 4.230055 -1.443481 -0.808661
C 4.697414 -0.109729 -0.891330
H -1.505067 -1.103252 -1.162826
H -2.685942 -2.138785 -0.265382
H -4.278829 -0.871931 1.428698
H -4.015483 0.906505 1.566839
H -1.829747 0.555128 2.167353
H -1.664826 -1.207432 1.900039
H -3.316351 0.064829 -2.348310
H -3.567804 -1.718036 -2.532565
H -6.019950 0.279638 0.098968
H -4.765234 1.250456 -0.772475
H 2.555343 -2.742619 -0.283279
H 4.183326 1.995229 -0.560176
H 4.883348 -2.270896 -1.105118
H 5.710974 0.096013 -1.250464
H -0.563070 -2.399339 0.837727


