%chk=000234623.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000234623

0 1
O 1.979622 0.828070 1.190977
O 2.833290 2.765655 -1.104677
O 3.135147 -0.670076 -1.659418
O 3.781003 -2.209957 0.378795
O -4.006449 0.257223 0.914537
N 0.091055 0.653968 -0.224707
N -1.178412 -1.091670 -0.988150
N -1.536608 1.687553 1.357780
N -3.977706 -1.655229 -0.318079
N -5.344258 -1.949594 -0.085507
C 2.283921 1.448913 -1.111019
C 1.294505 1.439721 0.087464
C 3.364949 0.397687 -0.742496
C 3.095608 0.015924 0.737828
C 2.702946 -1.448762 0.970784
C -1.179051 0.766046 0.391876
C 0.026218 -0.539520 -1.041851
C -1.954766 -0.303764 -0.116333
C -3.360600 -0.522220 0.204540
H 1.817074 1.229674 -2.096639
H 1.035090 2.461334 0.458012
H 4.396716 0.780714 -0.888468
H 3.931872 0.323022 1.404818
H 1.751731 -1.713238 0.472546
H 2.633713 -1.679035 2.048684
H 3.274726 2.955417 -1.962671
H 3.634253 -1.491587 -1.368193
H 0.886371 -0.875082 -1.616057
H 3.640895 -3.166405 0.539660
H -1.080174 2.584354 1.382567
H -2.542334 1.701103 1.584021
H -3.509946 -2.322899 -0.936905
H -5.504432 -2.044952 0.928876
H -5.924972 -1.148386 -0.376196


%chk=000234623-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000234623

0 1
O 1.925309 1.032985 1.123643
O 2.865644 2.793536 -1.154877
O 3.021216 -0.835458 -1.596697
O 3.802734 -2.143875 0.590946
O -3.875397 0.119499 1.230575
N 0.063409 0.575916 -0.380794
N -1.355782 -0.959572 -1.284975
N -1.351469 1.518431 1.404225
N -4.050141 -1.526147 -0.432002
N -5.385284 -1.893590 -0.122001
C 2.287351 1.448974 -1.211699
C 1.213336 1.439546 -0.107558
C 3.302676 0.349576 -0.790029
C 3.061090 0.148901 0.746599
C 2.702204 -1.299565 1.124851
C -1.124959 0.650595 0.362482
C -0.127954 -0.440047 -1.360554
C -1.997771 -0.290270 -0.215897
C -3.358679 -0.536415 0.248698
H 1.885563 1.220496 -2.216052
H 0.850833 2.463023 0.087413
H 4.341329 0.694035 -0.966556
H 3.927255 0.493574 1.335528
H 1.738298 -1.587523 0.665460
H 2.637687 -1.392300 2.223959
H 3.562923 2.877487 -1.852930
H 3.452719 -1.613144 -1.131159
H 0.670208 -0.753840 -2.028103
H 3.746083 -3.059330 0.957909
H -0.584730 1.864417 1.978636
H -2.297982 1.439596 1.797577
H -3.594281 -2.014455 -1.206187
H -5.445289 -2.231130 0.849684
H -6.017151 -1.089923 -0.253713


