%chk=000189108.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189108

0 1
O 1.287904 -0.543928 -1.275669
O 1.417373 2.540048 0.372325
O 3.617882 1.290365 -0.228942
O 3.001448 -2.235045 1.494164
O -4.614811 -1.096295 0.428742
N -3.106605 0.600581 0.321944
N -1.594490 2.438291 0.149824
N -2.476109 -1.664472 -0.363241
C 1.311296 1.125493 0.474667
C 2.689194 0.415966 0.411597
C 0.525756 0.589858 -0.759265
C 2.403775 -0.856925 -0.409010
C -0.864098 0.158812 -0.426421
C 2.004168 -2.041795 0.489718
C -1.832019 1.076868 0.027699
C -1.262812 -1.190446 -0.628428
C -3.478768 -0.829784 0.130223
H 0.784338 0.943586 1.435911
H 3.152208 0.218368 1.404979
H 0.539201 1.317368 -1.604086
H 3.224259 -1.117278 -1.109734
H 1.848387 -2.962564 -0.097986
H 1.085682 -1.826885 1.072510
H 2.345874 2.804358 0.110554
H 3.477136 1.297772 -1.206395
H -0.526584 -1.908284 -1.034770
H 3.792204 -2.675985 1.118594
H -3.844819 1.233449 0.642974
H -2.246764 3.037209 0.631022
H -0.639904 2.797393 0.093301


%chk=000189108-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000189108

0 1
O 1.330679 -0.628616 -1.247686
O 1.309643 2.511233 0.596948
O 3.465533 1.424457 -0.580309
O 3.303422 -2.242919 1.563855
O -4.855088 -0.917132 0.142516
N -3.135952 0.648068 0.212705
N -1.501863 2.363959 0.362318
N -2.696009 -1.602785 -0.568508
C 1.319079 1.049401 0.533624
C 2.750390 0.489726 0.318662
C 0.529166 0.513190 -0.712834
C 2.488160 -0.871357 -0.334353
C -0.903820 0.106793 -0.436516
C 2.157507 -1.989042 0.681220
C -1.829052 1.063828 0.052886
C -1.422415 -1.185239 -0.732874
C -3.633734 -0.693681 -0.075072
H 0.879515 0.691381 1.477918
H 3.352920 0.425293 1.235539
H 0.555582 1.306039 -1.492600
H 3.334030 -1.183808 -0.975359
H 1.840233 -2.895574 0.129885
H 1.335310 -1.689014 1.351255
H 2.110773 2.813200 0.080035
H 3.267548 1.181109 -1.522668
H -0.726446 -1.925714 -1.144133
H 3.975579 -2.794100 1.090525
H -3.852126 1.285240 0.576024
H -2.214742 3.011345 0.694896
H -0.513518 2.670815 0.388902


