%chk=000259133.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259133

0 1
O -1.842583 -2.014681 -1.366836
O 2.778248 2.733754 0.457241
O 2.270120 -3.795424 -0.029156
O 3.657851 0.799231 -0.311664
O -0.671740 -0.034283 -1.298529
N 0.274001 -2.053523 -0.614357
N 3.930807 -2.249225 -0.230934
N 5.730994 3.465382 1.929278
C 1.590063 -1.470446 -0.276815
C 1.538439 -0.672315 1.046355
C 1.452941 0.830744 0.781798
C 2.603261 -2.630072 -0.165663
C 2.743515 1.364173 0.245740
C -0.730814 -1.238157 -1.102281
C -3.040198 -1.301836 -1.820226
C -3.798025 -0.779436 -0.633853
C -4.839042 -1.531402 -0.071961
C -3.461963 0.468159 -0.086690
C -5.548150 -1.030339 1.023931
C -4.172862 0.964184 1.008278
C -5.217912 0.217031 1.562887
C 3.952920 3.459323 0.012635
C 4.947215 3.462694 1.082488
H 1.903584 -0.789042 -1.122447
H 2.417896 -0.901824 1.682489
H 0.660372 -0.990607 1.649772
H 0.627775 1.043146 0.041251
H 1.149371 1.382272 1.698839
H 0.127197 -3.055400 -0.442236
H -2.740480 -0.502351 -2.524747
H -3.563780 -2.113456 -2.361442
H 4.659830 -2.944377 -0.170653
H 4.222321 -1.282678 -0.345508
H -5.094269 -2.507190 -0.482733
H -2.634786 1.040691 -0.516171
H -6.357568 -1.614434 1.458802
H -3.913467 1.933723 1.430001
H -5.772804 0.606036 2.415012
H 3.544338 4.476118 -0.184242
H 4.355882 3.003442 -0.920755


%chk=000259133-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000259133

0 1
O -1.869099 -1.920534 -1.419423
O 3.088528 2.821532 0.223902
O 2.104505 -3.786198 -0.206944
O 3.975727 0.683905 0.033943
O -0.717713 0.126862 -1.154604
N 0.261820 -1.932838 -0.626419
N 3.850745 -2.250997 0.002590
N 6.093892 3.673192 1.802046
C 1.568036 -1.379876 -0.269086
C 1.538237 -0.520921 1.046712
C 1.630253 0.995958 0.784624
C 2.532331 -2.591170 -0.154278
C 3.001888 1.424472 0.320433
C -0.758802 -1.138542 -1.065739
C -3.096864 -1.153385 -1.822861
C -3.955347 -0.795539 -0.628115
C -4.952717 -1.690949 -0.164691
C -3.773578 0.442747 0.040879
C -5.753153 -1.359301 0.951034
C -4.574244 0.776398 1.155570
C -5.565688 -0.123325 1.613057
C 4.397006 3.365343 -0.230097
C 5.331093 3.530650 0.897092
H 1.929241 -0.737956 -1.097832
H 2.350358 -0.835089 1.726536
H 0.584873 -0.731169 1.560598
H 0.880714 1.277046 0.016649
H 1.380631 1.579154 1.690824
H 0.187758 -2.958792 -0.616976
H -2.769589 -0.254059 -2.372185
H -3.607204 -1.856059 -2.500102
H 4.540410 -2.996373 0.091707
H 4.136119 -1.262775 0.024174
H -5.097808 -2.649975 -0.677096
H -2.993629 1.126551 -0.312001
H -6.521323 -2.057900 1.301009
H -4.428865 1.735700 1.664987
H -6.188598 0.136795 2.476456
H 4.153894 4.342257 -0.676063
H 4.844659 2.692765 -0.983411


