%chk=000259340.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259340

0 1
O 4.774591 -0.598896 -0.425808
O 0.959985 1.581867 0.583905
O -1.934156 -2.453349 0.257451
O -5.166354 0.710771 -0.529956
N 2.351821 -0.214549 1.053915
N 0.129561 -0.557549 0.252971
N -3.552327 -0.900689 -0.140904
N -2.988708 1.428055 -0.316587
C 3.540876 0.673160 1.107493
C -1.228411 -0.156786 0.085622
C 4.275526 0.748045 -0.237304
C 1.139598 0.370193 0.617903
C -2.196850 -1.280534 0.085050
C -1.634044 1.131630 -0.109325
C -4.000087 0.431436 -0.344209
C 5.457142 -0.790927 -1.677588
H 4.219764 0.256963 1.890352
H 3.233742 1.696437 1.433357
H 5.125795 1.450646 -0.200265
H 3.606949 1.017413 -1.073149
H 2.583366 -1.166356 0.749722
H 0.256135 -1.563422 0.428030
H -0.928937 1.985952 -0.101002
H -4.269285 -1.642185 -0.153627
H -3.279654 2.400432 -0.449038
H 5.755683 -1.845988 -1.626927
H 6.337446 -0.144612 -1.740100
H 4.778532 -0.620361 -2.518382


%chk=000259340-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000259340

0 1
O 4.831947 -0.787602 -0.326744
O 0.791648 1.859506 0.713065
O -1.682625 -2.332599 -0.453275
O -5.485387 0.410847 -0.148528
N 2.306568 0.093967 0.438131
N 0.015215 -0.288418 0.163728
N -3.563472 -0.940259 -0.293978
N -3.359017 1.329817 0.246587
C 3.495117 0.903249 0.722315
C -1.358075 -0.004198 0.110742
C 4.568141 0.659738 -0.341626
C 1.031436 0.634223 0.456019
C -2.177168 -1.181938 -0.230611
C -1.967950 1.213089 0.339787
C -4.233716 0.282299 -0.069919
C 5.810171 -1.196087 -1.333409
H 3.908480 0.647548 1.717767
H 3.186554 1.962364 0.738857
H 5.493339 1.224778 -0.096080
H 4.207072 0.970945 -1.345817
H 2.481975 -0.885190 0.201605
H 0.224558 -1.274982 -0.036165
H -1.386216 2.099148 0.595342
H -4.162746 -1.737777 -0.528326
H -3.805875 2.232088 0.416766
H 5.926863 -2.286018 -1.228877
H 6.790845 -0.703593 -1.165610
H 5.460017 -0.958146 -2.360146


