%chk=000202166.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202166

0 1
O 3.886930 -1.412989 -0.166676
O 1.170272 3.401793 -0.197985
N 1.552255 0.233286 0.093057
C 0.401596 1.076851 -0.399944
C 2.861182 0.793617 -0.390611
C 1.449759 -1.194775 -0.361532
C 4.003048 -0.031188 0.224536
C 2.624602 -1.986337 0.233785
C -0.925679 0.369442 -0.209821
C 0.363392 2.393068 0.421771
C -1.774619 0.173302 -1.307659
C -1.332079 -0.066846 1.061278
C -3.013061 -0.449692 -1.138938
C -2.568010 -0.689976 1.231188
C -3.419823 -0.886579 0.131282
C -4.751177 -1.538682 0.315523
H 0.529621 1.354183 -1.481879
H 2.945878 1.855420 -0.061252
H 2.949663 0.787817 -1.499384
H 1.444827 -1.293885 -1.467966
H 0.493633 -1.625659 0.008465
H 4.989512 0.250990 -0.182706
H 4.007422 0.032815 1.327092
H 2.580365 -2.016583 1.336797
H 2.688700 -3.008865 -0.177359
H 0.686441 2.240174 1.465941
H -0.646437 2.847436 0.402231
H -1.474600 0.509391 -2.299593
H -0.668525 0.074836 1.915683
H -3.664841 -0.593552 -1.998413
H -2.873234 -1.023014 2.221204
H 2.126639 3.176825 -0.101930
H -4.749678 -2.266317 1.138053
H -5.521546 -0.788034 0.548686
H -5.083325 -2.073671 -0.584122


%chk=000202166-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000202166

0 1
O 4.041949 -1.323995 0.071995
O 1.196448 3.369354 -0.803561
N 1.537487 0.168793 -0.019067
C 0.410437 0.965924 -0.593616
C 2.846587 0.859168 0.087449
C 1.703065 -1.126218 -0.735493
C 3.867584 -0.055563 0.790522
C 2.739918 -2.007534 -0.025750
C -0.926850 0.278632 -0.298424
C 0.365634 2.422611 -0.047821
C -1.959650 0.271134 -1.267030
C -1.185118 -0.300293 0.968694
C -3.219063 -0.298320 -0.976445
C -2.444606 -0.868899 1.256047
C -3.486553 -0.874272 0.292212
C -4.850222 -1.461288 0.614861
H 0.518559 1.065765 -1.704054
H 2.741790 1.769926 0.706943
H 3.256972 1.143835 -0.917521
H 2.025787 -0.959639 -1.793848
H 0.729728 -1.648040 -0.755673
H 4.865385 0.413447 0.813403
H 3.523386 -0.255073 1.828821
H 2.377012 -2.265389 0.992634
H 2.933838 -2.931072 -0.595435
H 0.609947 2.425143 1.036384
H -0.654148 2.817683 -0.171883
H -1.775632 0.707002 -2.257433
H -0.378243 -0.319696 1.709566
H -4.002611 -0.301611 -1.744325
H -2.624057 -1.317278 2.241441
H 2.145783 3.092865 -0.764013
H -4.772555 -2.294382 1.335743
H -5.514949 -0.698636 1.065674
H -5.353936 -1.839483 -0.292198


