%chk=000299024.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299024

0 1
O -0.883815 0.987431 0.527102
O -3.960200 0.077928 0.032951
O -2.512053 -1.644017 0.295989
O 2.095796 2.863367 -1.271950
O 0.073250 2.894400 -0.503909
O 3.996486 -2.915182 -0.076105
O 4.792532 -1.131945 -1.011250
N 1.133882 2.343404 -0.731163
N 3.911340 -1.756423 -0.447366
C -2.003240 0.499571 1.347563
C 0.225089 0.238826 0.328162
C 1.281223 0.937703 -0.322901
C -2.709258 1.795516 1.676483
C 0.388013 -1.112455 0.702229
C -2.822234 -0.492287 0.501352
C 2.491135 0.275179 -0.579379
C 2.640758 -1.057660 -0.189561
C 1.584127 -1.755902 0.444907
C -4.860124 -0.747066 -0.790765
C -5.652083 -1.681794 0.094146
H -1.606771 -0.029420 2.244030
H -3.801452 1.676921 1.729575
H -2.356341 2.233449 2.618141
H -2.514973 2.550108 0.885974
H -0.445705 -1.670212 1.144796
H 3.315716 0.811562 -1.084017
H 1.731159 -2.809816 0.721909
H -5.473196 0.045140 -1.260416
H -4.252153 -1.277497 -1.544926
H -6.436709 -2.199132 -0.473840
H -5.009245 -2.456921 0.538851
H -6.140755 -1.148375 0.919787


%chk=000299024-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000299024

0 1
O -0.949017 1.014036 0.631339
O -3.633083 -0.063835 -0.117809
O -2.760393 -1.851695 1.101789
O 2.148095 3.065497 -0.940920
O -0.093883 2.760782 -1.245462
O 4.024736 -2.925389 -0.217521
O 4.782689 -1.041674 -1.263907
N 1.070829 2.351575 -0.884880
N 3.885606 -1.702775 -0.612198
C -1.972292 0.442634 1.562183
C 0.183120 0.285152 0.320851
C 1.219519 0.953606 -0.408330
C -2.789292 1.639114 2.044120
C 0.401868 -1.065200 0.715967
C -2.819081 -0.625031 0.837976
C 2.436406 0.316088 -0.698769
C 2.614289 -1.018585 -0.293832
C 1.605534 -1.715885 0.407288
C -4.498646 -0.998205 -0.918029
C -5.812144 -1.270956 -0.183223
H -1.455006 -0.065300 2.397675
H -3.577157 1.304464 2.742112
H -2.133735 2.353307 2.569093
H -3.262385 2.143681 1.187826
H -0.378142 -1.619274 1.244969
H 3.228526 0.851452 -1.228498
H 1.777221 -2.755189 0.699055
H -4.649487 -0.451329 -1.861193
H -3.930211 -1.927493 -1.096637
H -6.471226 -1.882993 -0.825980
H -5.634742 -1.826893 0.752503
H -6.338321 -0.329285 0.048840


