%chk=000188824.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188824

0 1
O -1.145492 -0.047467 0.055364
O 1.971416 1.974171 -1.803197
O 1.862878 3.139928 0.103969
O -0.868847 -1.476088 1.784234
N 1.933574 -0.637812 -0.031820
C 1.187704 0.274979 0.944171
C -0.144689 0.931111 0.524844
C 2.021993 -2.018880 0.593118
C 1.279764 -0.767670 -1.383327
C 3.337197 -0.107428 -0.240734
C -0.083691 1.941209 -0.598937
C 1.386460 2.448884 -0.800903
C -1.510047 -1.126794 0.816340
C -2.743445 -1.744168 0.216912
C -2.664735 -3.263428 0.236854
H 1.859491 1.141117 1.231035
H 0.996779 -0.287411 1.894057
H -0.585119 1.376663 1.452349
H 1.013685 -2.390328 0.873795
H 2.474487 -2.748454 -0.096789
H 2.629597 -2.007596 1.514149
H 1.774210 -1.520964 -2.008967
H 0.205192 -0.995795 -1.311828
H 1.363803 0.221608 -1.949975
H 3.298074 0.871361 -0.818526
H 3.852692 0.101839 0.706717
H 3.950860 -0.791184 -0.842758
H -0.460786 1.526610 -1.551381
H -0.722739 2.816031 -0.384428
H -3.624893 -1.389533 0.800017
H -2.907071 -1.364488 -0.816908
H -2.433875 -3.641749 1.244016
H -3.620561 -3.709879 -0.068192
H -1.894966 -3.644696 -0.444172


%chk=000188824-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000188824

0 1
O -0.986687 -0.361141 -0.123780
O 2.264179 2.339596 -0.735896
O 0.859281 4.118391 -0.160184
O -1.394112 -1.082238 2.060281
N 2.104531 -0.665443 -0.282884
C 1.305049 0.171606 0.769956
C -0.074858 0.742193 0.401780
C 1.878193 -2.147039 -0.026117
C 1.740789 -0.348709 -1.736143
C 3.582744 -0.313451 -0.091837
C -0.143463 1.922644 -0.578133
C 1.098953 2.906207 -0.470543
C -1.651108 -1.144375 0.835060
C -2.705379 -2.022513 0.179759
C -3.060648 -3.261799 1.023830
H 1.939175 1.039631 1.005117
H 1.199903 -0.489913 1.646756
H -0.490726 1.047391 1.382821
H 0.804597 -2.360661 -0.129036
H 2.450496 -2.730505 -0.764891
H 2.214472 -2.398944 0.991725
H 2.394986 -0.958164 -2.382020
H 0.684309 -0.605280 -1.897240
H 1.930108 0.737484 -1.853664
H 3.672746 0.762092 -0.325027
H 3.865054 -0.516312 0.953800
H 4.187566 -0.932166 -0.774816
H -0.191974 1.550547 -1.616667
H -1.064869 2.494715 -0.381359
H -3.603889 -1.388362 0.038081
H -2.367123 -2.292757 -0.836686
H -3.352787 -2.965450 2.044986
H -3.898815 -3.812363 0.562794
H -2.201794 -3.951213 1.109276


