%chk=000187971.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187971

0 1
O 3.269462 1.247366 0.715778
O -2.402780 -1.056741 1.770921
O -2.843567 -1.670986 -0.344712
O 3.707026 -1.345761 0.162372
N 0.043114 0.260505 -0.770204
N -3.566779 1.324128 -0.033303
C -1.309344 0.774205 -1.071881
C -2.254847 0.675136 0.159361
C 1.024409 1.086600 -0.160153
C 0.315808 -1.089973 -1.004445
C 2.245850 0.545223 0.144002
C 0.700490 2.519033 0.111156
C 1.521701 -1.639276 -0.709227
C -2.552180 -0.800525 0.440903
C 2.618764 -0.887353 -0.108429
H -1.249997 1.830895 -1.417645
H -1.741923 0.198653 -1.927957
H -1.757243 1.121303 1.068016
H -0.499064 -1.682806 -1.446767
H 1.562777 3.043791 0.560658
H -0.132975 2.628749 0.819962
H 0.450983 3.067397 -0.809328
H 1.728344 -2.690100 -0.913038
H -4.016453 1.036200 -0.898454
H -3.490820 2.335424 -0.024724
H 3.013219 2.195295 0.884321
H -2.600674 -2.006383 2.011617


%chk=000187971-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000187971

0 1
O 3.371026 1.298240 0.731520
O -2.764556 -1.026352 1.758369
O -2.790816 -1.677481 -0.475905
O 3.828659 -1.366413 0.202527
N 0.103204 0.280558 -0.752582
N -3.474133 1.434476 -0.222820
C -1.247738 0.795140 -1.064746
C -2.252215 0.677939 0.111564
C 1.079900 1.094147 -0.128709
C 0.397028 -1.047845 -1.049916
C 2.331802 0.552370 0.160181
C 0.744627 2.546045 0.160045
C 1.615295 -1.616307 -0.746401
C -2.594808 -0.795580 0.392566
C 2.691685 -0.867780 -0.098566
H -1.205293 1.855971 -1.354465
H -1.640658 0.225402 -1.926009
H -1.816522 1.111304 1.026483
H -0.406726 -1.608764 -1.533959
H 1.358563 2.935025 0.992917
H -0.302109 2.686830 0.475902
H 0.918295 3.198783 -0.717539
H 1.806455 -2.662031 -1.001130
H -4.001762 1.054172 -1.015946
H -4.072018 1.655436 0.578373
H 3.142180 2.259067 0.792089
H -3.036066 -1.972354 1.914955


