%chk=000220575.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220575

0 1
O -6.905336 -0.099708 1.073236
O -6.852386 0.707787 -0.931452
N 5.739186 0.554137 0.053775
N 0.139088 -0.176828 -0.140957
N -0.649072 0.636997 0.394071
N -6.309899 0.319031 0.091943
C 2.387804 -0.976259 -0.533497
C 4.351270 0.345875 0.108479
C 1.832508 -2.236416 -1.143692
C 3.770784 -0.815517 -0.458181
C 1.540355 0.042457 -0.017697
C 3.490539 1.353434 0.629774
C 2.119833 1.197119 0.561033
C 1.685868 -3.327548 -0.083673
C 6.630155 -0.611917 -0.174149
C 6.343655 1.578610 0.943099
C -2.065297 0.430445 0.250181
C -2.790727 -0.046870 1.361525
C -2.729311 0.862067 -0.915921
C -4.839737 0.357283 0.146184
C -4.179215 -0.081249 1.308347
C -4.118663 0.828481 -0.965250
H 0.844407 -2.041576 -1.616621
H 2.486082 -2.588990 -1.967328
H 4.409478 -1.603279 -0.853284
H 3.904998 2.255580 1.073009
H 1.462751 1.976857 0.960038
H 2.643396 -3.558910 0.396457
H 1.298295 -4.253485 -0.523509
H 0.986100 -3.020267 0.704816
H 7.648174 -0.260665 -0.412902
H 6.278239 -1.192127 -1.046891
H 6.687493 -1.288183 0.694434
H 5.805067 2.537997 0.835346
H 7.388574 1.763581 0.642114
H 6.332066 1.288959 2.006631
H -2.262193 -0.380919 2.254852
H -2.154466 1.220063 -1.770365
H -4.766400 -0.446982 2.158583
H -4.658363 1.160234 -1.859760


%chk=000220575-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000220575

0 1
O -6.988788 0.862091 0.882634
O -6.731009 -0.805353 -0.656653
N 5.779145 0.408047 0.422988
N 0.166157 -0.133666 -0.075976
N -0.598349 0.643537 0.672565
N -6.252261 0.079961 0.158999
C 2.410058 -0.800189 -0.701975
C 4.398381 0.288000 0.316495
C 1.832185 -1.849421 -1.639143
C 3.802272 -0.660670 -0.578418
C 1.552356 0.040359 0.090653
C 3.521745 1.118989 1.100132
C 2.140052 0.992564 0.982627
C 1.378845 -3.128779 -0.884813
C 6.662997 -0.443564 -0.389708
C 6.373144 1.391339 1.344635
C -1.994599 0.436467 0.477702
C -2.847236 1.273825 1.253091
C -2.570042 -0.525921 -0.408625
C -4.787511 0.203951 0.269508
C -4.243304 1.164627 1.154321
C -3.962233 -0.643043 -0.513202
H 0.960220 -1.429362 -2.170062
H 2.591426 -2.120971 -2.396924
H 4.438421 -1.303801 -1.193272
H 3.934657 1.857269 1.792327
H 1.466189 1.622994 1.571026
H 2.216550 -3.580737 -0.323018
H 0.994106 -3.882587 -1.595911
H 0.574762 -2.884338 -0.169337
H 7.712938 -0.205750 -0.160960
H 6.502352 -0.279301 -1.473423
H 6.501020 -1.518283 -0.175965
H 6.073039 2.425827 1.086817
H 7.470383 1.331282 1.283947
H 6.078009 1.196266 2.394099
H -2.380927 2.000944 1.924946
H -1.900953 -1.160645 -0.996077
H -4.916784 1.796513 1.738633
H -4.432316 -1.369176 -1.181886


