%chk=000231311.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231311

0 1
O 0.110887 3.212319 -0.467160
N -1.677054 0.495666 1.189311
N 0.714326 2.141840 1.433936
C 0.038305 0.769241 -0.566684
C -0.269667 1.014636 -2.073593
C 1.355492 0.009585 -0.436602
C -1.125730 -0.000665 0.048538
C 0.238279 2.152629 0.121316
C -1.634789 1.644139 -2.324017
C 2.493727 0.513481 -1.091090
C 1.472732 -1.153791 0.335479
C -1.612873 -1.181938 -0.554357
C 3.717953 -0.148942 -0.992008
C 2.701691 -1.815842 0.431593
C -2.698027 -1.839085 0.023535
C 3.825254 -1.319512 -0.232924
C -2.737146 -0.154229 1.740031
C -3.279532 -1.322208 1.187362
H -0.178226 0.058443 -2.622933
H 0.512576 1.688855 -2.486788
H -2.462302 1.010571 -1.990686
H -1.781586 1.848891 -3.390358
H -1.719963 2.609436 -1.797270
H 2.425250 1.435214 -1.671886
H 0.616016 -1.558248 0.872640
H -1.145256 -1.567557 -1.459035
H 4.592640 0.250282 -1.503955
H 2.779782 -2.721571 1.031149
H 0.591922 1.326876 2.016585
H 0.720183 3.019573 1.936294
H -3.092311 -2.749712 -0.428709
H 4.779895 -1.836037 -0.157268
H -3.148052 0.294195 2.652391
H -4.130494 -1.813136 1.651960


%chk=000231311-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000231311

0 1
O 0.786033 3.141230 -0.789537
N -1.329516 0.201906 1.449787
N 0.033125 2.460538 1.296783
C 0.022513 0.790246 -0.588322
C -0.239686 0.939726 -2.128283
C 1.366827 0.007349 -0.404224
C -1.121077 0.015254 0.103999
C 0.288530 2.250134 -0.029426
C -1.522679 1.711981 -2.502483
C 2.574791 0.590353 -0.876114
C 1.426682 -1.284547 0.177333
C -1.894728 -0.947397 -0.599542
C 3.800292 -0.099849 -0.769119
C 2.655698 -1.976592 0.282277
C -2.874518 -1.702194 0.078181
C 3.848959 -1.390138 -0.191579
C -2.278419 -0.525042 2.101618
C -3.078135 -1.493270 1.460330
H -0.224110 -0.062449 -2.597664
H 0.622829 1.487872 -2.541506
H -2.439473 1.236285 -2.109488
H -1.620837 1.772890 -3.601985
H -1.472179 2.743684 -2.114047
H 2.552981 1.598604 -1.304278
H 0.519752 -1.763653 0.558852
H -1.725957 -1.113602 -1.665194
H 4.719014 0.373168 -1.134366
H 2.676547 -2.973899 0.736747
H -0.441797 1.693283 1.819219
H 0.245815 3.378573 1.686976
H -3.467376 -2.444932 -0.466168
H 4.801289 -1.925947 -0.109467
H -2.390587 -0.318216 3.171664
H -3.826701 -2.057951 2.023823


