%chk=000235219.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000235219

0 1
O 1.857927 0.964486 -1.992928
O -1.858321 0.933024 2.008241
N 1.425873 2.514937 -0.319269
N -1.423948 2.510546 0.360750
N 3.047830 0.771755 -0.003093
N -3.047690 0.774597 0.015063
C 0.423649 3.117054 -1.243181
C 0.988157 2.497919 1.112023
C -0.986222 2.517239 -1.070618
C -0.421184 3.095972 1.294736
C 2.077663 1.343921 -0.854083
C -2.077220 1.331544 0.875766
C 3.869358 -0.353866 -0.333640
C -3.870598 -0.355413 0.326667
C 4.886750 -0.735539 0.626329
C -4.888277 -0.719815 -0.639686
C 5.690865 -1.867993 0.332097
C -5.693756 -1.856087 -0.364523
C 3.701406 -1.071481 -1.501484
C -3.703677 -1.092623 1.482393
C 5.120337 -0.030539 1.848749
C -5.120848 0.005777 -1.850192
C 5.489823 -2.594262 -0.883351
C -5.493761 -2.602784 0.838656
C 4.520868 -2.199075 -1.770194
C -4.524496 -2.223587 1.732117
C 6.702327 -2.270770 1.263843
C -6.705534 -2.242069 -1.303013
C 6.096296 -0.435485 2.724979
C -6.097134 -0.383342 -2.733204
C 6.899310 -1.573981 2.428573
C -6.901517 -1.525695 -2.455970
H 0.761445 2.974487 -2.299338
H 0.420408 4.213900 -1.051843
H 1.725638 3.100097 1.689876
H 0.993981 1.463939 1.529129
H -1.723152 3.129690 -1.638284
H -0.992887 1.490422 -1.505062
H -0.759122 2.935816 2.348328
H -0.416953 4.195909 1.122044
H 3.275787 1.247613 0.876309
H -3.274809 1.265179 -0.856424
H 2.943056 -0.786306 -2.239782
H -2.945129 -0.820690 2.225469
H 4.511623 0.843262 2.083969
H -4.511085 0.882678 -2.070694
H 6.117560 -3.458874 -1.087325
H -6.122537 -3.469949 1.028074
H 4.358846 -2.743064 -2.701644
H -4.363264 -2.783241 2.654379
H 7.309848 -3.142835 1.024499
H -7.314106 -3.117301 -1.078353
H 6.271712 0.102895 3.654646
H -6.271775 0.170697 -3.653773
H 7.666226 -1.875902 3.140578
H -7.668666 -1.814790 -3.173030


%chk=000235219-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000235219

0 1
O 2.474712 1.109586 -2.423960
O -2.473145 1.071630 2.440178
N 1.318292 1.733539 -0.488101
N -1.317679 1.728394 0.514676
N 3.366887 0.587829 -0.296708
N -3.368410 0.589538 0.304873
C 0.249711 2.340942 -1.299119
C 1.118146 1.695552 0.980871
C -1.117694 1.714678 -0.954755
C -0.247609 2.319562 1.335616
C 2.400866 1.134416 -1.154989
C -2.400619 1.119153 1.171773
C 4.557893 -0.104405 -0.648365
C -4.559151 -0.108752 0.645434
C 5.388336 -0.600085 0.437180
C -5.390318 -0.586043 -0.447767
C 6.612983 -1.302959 0.103327
C -6.614584 -1.294696 -0.124922
C 4.942517 -0.314742 -1.982912
C -4.942699 -0.341913 1.976504
C 5.067158 -0.435378 1.827532
C -5.070109 -0.397908 -1.835361
C 6.973710 -1.499559 -1.269401
C -6.974219 -1.514746 1.244527
C 6.148187 -1.013450 -2.282379
C -6.147956 -1.045887 2.265007
C 7.449034 -1.795451 1.160100
C -7.451348 -1.769330 -1.189278
C 5.901435 -0.926644 2.835493
C -5.905067 -0.872145 -2.850892
C 7.108216 -1.614135 2.500729
C -7.111535 -1.565307 -2.526899
H 0.499411 2.156214 -2.356532
H 0.218152 3.436751 -1.142934
H 1.912020 2.264730 1.512355
H 1.131941 0.646297 1.343080
H -1.910046 2.294836 -1.476587
H -1.134346 0.671744 -1.334618
H -0.497762 2.117840 2.389808
H -0.213233 3.417679 1.197467
H 3.211129 0.703021 0.703170
H -3.214237 0.723832 -0.692874
H 4.305341 0.066536 -2.781960
H -4.304921 0.025754 2.781424
H 4.151004 0.078643 2.145548
H -4.154061 0.121208 -2.145226
H 7.900833 -2.033942 -1.505018
H -7.901110 -2.053189 1.471668
H 6.419494 -1.161399 -3.333318
H -6.418384 -1.211806 3.313488
H 8.371007 -2.323817 0.889551
H -8.373069 -2.302340 -0.927091
H 5.628463 -0.786740 3.887052
H -5.632805 -0.714563 -3.900133
H 7.756674 -1.996394 3.296212
H -7.760531 -1.934183 -3.328241


