%chk=000287889.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287889

0 1
O 1.606027 -1.234363 -0.610269
O 4.121668 0.219534 2.994972
O -1.601477 -1.245867 0.604228
O -4.123141 0.215761 -2.993673
N 2.564113 -0.465166 1.390232
N -2.562699 -0.469838 -1.392123
N 1.082528 1.335810 2.205397
N -1.090376 1.344027 -2.195259
C 1.320954 -0.111829 2.144790
C -1.321147 -0.105185 -2.143938
C 4.042383 -1.099153 -0.305959
C 4.819044 -0.663488 0.803965
C -4.038371 -1.122047 0.299412
C -4.816827 -0.684014 -0.808320
C 2.584362 -0.971296 0.038337
C 3.891512 -0.231631 1.903155
C -2.580886 -0.984182 -0.043310
C -3.891094 -0.240584 -1.904412
C 0.571005 2.028304 1.074567
C -0.582088 2.032013 -1.060294
C -0.003936 1.326687 0.005038
C 4.639900 -1.547183 -1.463787
C 6.196216 -0.675584 0.761722
C -4.634025 -1.580223 1.454224
C -6.193934 -0.703860 -0.766893
C 0.580885 3.441310 1.078159
C -0.598544 3.444984 -1.055394
C 6.054812 -1.560178 -1.511029
C 6.813258 -1.135937 -0.426330
C -6.048869 -1.601213 1.500619
C -6.809063 -1.174650 0.418057
C -0.010426 4.121928 0.013420
H 1.435670 -0.492437 3.191241
H 0.454326 -0.635905 1.648205
H -0.451965 -0.627864 -1.650370
H -1.433523 -0.479718 -3.192847
H 1.754123 1.851402 2.778695
H -1.764436 1.859789 -2.765449
H -0.001475 0.230496 0.001815
H 4.048386 -1.879732 -2.317731
H 6.794789 -0.342235 1.610395
H -4.041137 -1.914616 2.306495
H -6.793882 -0.368719 -1.613888
H 1.024756 3.992204 1.898889
H -1.044991 3.998699 -1.872821
H 6.548632 -1.909940 -2.419136
H 7.902922 -1.153010 -0.481942
H -6.541239 -1.959073 2.406356
H -7.898646 -1.197999 0.472973
H -0.012973 5.213271 0.016716


%chk=000287889-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000287889

0 1
O 1.656487 -1.350687 -0.576952
O 4.250069 0.411949 2.941042
O -1.650461 -1.363118 0.568903
O -4.252664 0.408098 -2.938405
N 2.662600 -0.395710 1.369641
N -2.661247 -0.401134 -1.371817
N 1.238726 1.475729 2.124418
N -1.246984 1.482391 -2.114577
C 1.459012 0.048454 2.142045
C -1.459862 0.054097 -2.141200
C 4.119599 -1.218659 -0.252199
C 4.906463 -0.691383 0.800822
C -4.114183 -1.241220 0.244870
C -4.903624 -0.711545 -0.805012
C 2.670431 -1.029474 0.090879
C 3.982794 -0.151115 1.848328
C -2.665957 -1.042799 -0.096980
C -3.982622 -0.160431 -1.849206
C 0.629135 2.176107 1.061090
C -0.641660 2.179311 -1.046510
C -0.003942 1.477105 0.004826
C 4.708167 -1.798571 -1.385470
C 6.308090 -0.727250 0.756529
C -4.699906 -1.830964 1.374537
C -6.305057 -0.754738 -0.761076
C 0.626063 3.599540 1.066458
C -0.647618 3.602733 -1.042109
C 6.126044 -1.840437 -1.440386
C 6.913835 -1.313019 -0.385729
C -6.117558 -1.880314 1.429052
C -6.907926 -1.350478 0.377540
C -0.012908 4.288403 0.014508
H 1.628684 -0.267650 3.184645
H 0.597188 -0.504567 1.733095
H -0.595265 -0.497054 -1.735615
H -1.627760 -0.256281 -3.185801
H 1.778162 2.023436 2.795188
H -1.789469 2.031444 -2.781788
H -0.000279 0.386877 0.000946
H 4.090027 -2.201434 -2.193807
H 6.905709 -0.315807 1.575924
H -4.079804 -2.235612 2.180476
H -6.904682 -0.341375 -1.578036
H 1.109219 4.151709 1.881169
H -1.134413 4.157403 -1.852948
H 6.621589 -2.285407 -2.309903
H 8.005845 -1.358662 -0.456691
H -6.610914 -2.333041 2.295807
H -7.999697 -1.402060 0.448106
H -0.016376 5.384711 0.018272


