%chk=000239399.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239399

0 1
O 2.220497 0.720773 1.584512
O -5.830591 1.739696 1.400062
O -4.756513 -2.510654 -0.684283
O 5.255302 0.205011 0.531012
O 3.653143 -0.579252 -0.865537
N -2.999711 0.117651 -0.372922
C -4.111354 0.218210 0.617596
C -3.298058 -0.834032 -1.472650
C -1.666243 0.149833 0.143909
C -4.788454 1.588282 0.427367
C -3.374553 -2.312184 -1.055966
C -0.607810 -0.540348 -0.482939
C -1.376898 0.997355 1.243916
C 0.706713 -0.395295 -0.034395
C -0.075395 1.135683 1.706680
C 0.956017 0.433801 1.058177
C 3.210047 -0.315247 1.550324
C 3.999109 -0.255525 0.244959
C 6.215953 0.340404 -0.567502
C 6.772854 -1.018237 -0.934830
H -3.761395 0.112369 1.667373
H -4.853643 -0.604434 0.474739
H -2.544867 -0.697775 -2.280991
H -4.283469 -0.538795 -1.913368
H -5.199393 1.713960 -0.588263
H -4.107519 2.430204 0.653759
H -2.732096 -2.546526 -0.189010
H -3.133692 -2.987416 -1.895239
H -0.789498 -1.182183 -1.341914
H -2.174462 1.559643 1.729783
H 1.520100 -0.907502 -0.555150
H 0.160846 1.784191 2.549220
H -6.559639 1.113751 1.224669
H -4.901404 -3.433873 -0.402862
H 3.851165 -0.049806 2.420698
H 2.768645 -1.318728 1.688192
H 6.962799 1.010941 -0.103823
H 5.709733 0.838505 -1.413505
H 7.149765 -1.553562 -0.054118
H 6.002093 -1.652571 -1.398231
H 7.599076 -0.931520 -1.650949


%chk=000239399-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239399

0 1
O 2.337719 -0.461979 2.254430
O -4.805806 2.981338 0.526997
O -5.005720 -2.216151 -0.433462
O 4.144978 0.278559 0.234972
O 4.287612 -1.957346 -0.422201
N -2.787950 -0.162997 -0.215023
C -3.837826 0.684411 0.375396
C -3.155770 -0.987948 -1.371649
C -1.509370 -0.264580 0.372903
C -3.788682 2.147494 -0.132070
C -3.661882 -2.397264 -1.013932
C -0.537196 -1.200209 -0.092999
C -1.125427 0.576937 1.467156
C 0.747050 -1.291617 0.490402
C 0.146758 0.479947 2.053220
C 1.093492 -0.451477 1.571111
C 3.343031 -1.399714 1.783597
C 3.956354 -1.079022 0.410424
C 4.760327 0.709783 -1.062559
C 6.287840 0.672156 -0.970402
H -3.766121 0.683923 1.478913
H -4.817244 0.234252 0.129982
H -2.300592 -1.072437 -2.068467
H -3.966165 -0.481603 -1.928301
H -3.900851 2.169777 -1.237506
H -2.828590 2.622006 0.126436
H -2.973516 -2.878245 -0.290325
H -3.717233 -3.018826 -1.934284
H -0.766379 -1.881199 -0.917663
H -1.818160 1.324418 1.863538
H 1.449517 -2.026957 0.084470
H 0.426316 1.131854 2.886764
H -5.705527 2.637087 0.295595
H -5.302927 -3.055038 -0.002266
H 4.145819 -1.350089 2.539983
H 2.957566 -2.436208 1.737668
H 4.374916 1.732194 -1.198692
H 4.386876 0.048160 -1.863828
H 6.645648 1.282683 -0.123581
H 6.648536 -0.362612 -0.846505
H 6.725778 1.081338 -1.899742


