%chk=000296151.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296151

0 1
O 4.653542 0.492146 0.030284
O -2.510031 -2.605072 1.072407
N -1.481880 0.306056 -1.631404
N -1.202743 -1.932455 -0.635398
C -0.612797 -0.906219 -1.525274
C 0.783501 -0.521978 -1.058280
C -2.374734 0.642204 -0.599758
C -2.769900 -0.328815 0.349630
C -2.193824 -1.686128 0.332822
C 1.862780 -0.615546 -1.955971
C 1.005775 -0.077628 0.250248
C -2.944012 1.939169 -0.558954
C -3.742706 -0.003919 1.310327
C 3.145301 -0.266438 -1.558245
C 2.286232 0.279984 0.678550
C 3.347962 0.180909 -0.232297
C -3.901837 2.232343 0.403771
C -4.304907 1.268057 1.342921
C 5.006137 0.949211 1.379550
C 6.501445 1.172127 1.283180
H -0.570720 -1.345109 -2.569221
H -1.028803 1.082848 -2.118168
H -0.739305 -2.842157 -0.631028
H 1.695574 -0.966681 -2.975565
H 0.168435 -0.009985 0.950012
H -2.645782 2.691801 -1.282618
H -4.045670 -0.772565 2.029260
H 3.995239 -0.331097 -2.234026
H 2.437695 0.619851 1.697255
H -4.347981 3.228038 0.433880
H -5.056176 1.516767 2.087732
H 4.445339 1.876088 1.588279
H 4.734937 0.155313 2.096357
H 6.915900 1.521092 2.236091
H 7.026201 0.247672 1.002008
H 6.746611 1.916114 0.511843


%chk=000296151-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000296151

0 1
O 4.738830 0.518926 -0.015911
O -2.571886 -2.615248 1.145420
N -1.529378 0.250264 -1.636835
N -1.289944 -1.926657 -0.659814
C -0.642984 -0.928635 -1.532662
C 0.780487 -0.563474 -1.077365
C -2.421962 0.627820 -0.633710
C -2.794392 -0.312948 0.375285
C -2.229549 -1.686756 0.346514
C 1.846409 -0.582785 -2.012248
C 1.054072 -0.176281 0.256700
C -3.008001 1.925388 -0.618709
C -3.729561 0.048738 1.372361
C 3.151539 -0.216568 -1.633690
C 2.354911 0.195263 0.654279
C 3.410419 0.176299 -0.296593
C -3.936877 2.266298 0.382836
C -4.304400 1.334133 1.388520
C 5.073923 0.924622 1.365877
C 6.567801 1.235156 1.383376
H -0.557821 -1.367191 -2.549478
H -1.217915 0.968460 -2.291231
H -0.884730 -2.865885 -0.657769
H 1.655717 -0.892382 -3.048516
H 0.246151 -0.169091 0.997321
H -2.733273 2.656949 -1.388541
H -3.990019 -0.710507 2.117667
H 3.982242 -0.232484 -2.345535
H 2.535797 0.487587 1.692553
H -4.377988 3.269820 0.381904
H -5.027790 1.611511 2.161373
H 4.473319 1.815091 1.643526
H 4.824913 0.097499 2.061884
H 6.878241 1.546873 2.397154
H 7.153978 0.345938 1.095669
H 6.804520 2.050259 0.678587


