%chk=000229410.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229410

0 1
O 3.067386 1.638823 0.457237
O -3.061313 1.648306 0.451923
N 2.546991 -0.624070 0.286909
N -2.548040 -0.616317 0.283151
N 4.327034 0.365139 -0.984322
N -4.322732 0.378302 -0.991354
C -0.000293 -0.583382 0.041352
C 0.002139 0.510312 -1.055939
C -0.001819 -1.964663 -0.667457
C 1.241774 -0.440540 0.969799
C -1.243282 -0.436790 0.967968
C 0.003766 1.938858 -0.525154
C -0.004346 -3.165083 0.272978
C 3.279145 0.545098 -0.042044
C -3.275884 0.555107 -0.047309
H -0.879996 0.372721 -1.712737
H 0.884904 0.370199 -1.711352
H 0.875288 -2.029865 -1.342629
H -0.878032 -2.027236 -1.344024
H 1.226781 0.564234 1.464033
H 1.201205 -1.198068 1.785642
H -1.225972 0.567936 1.462243
H -1.206230 -1.194419 1.783880
H 0.894153 2.153840 0.085973
H -0.887108 2.156476 0.084328
H 0.005597 2.662788 -1.347997
H -0.887694 -3.176534 0.922918
H -0.005454 -4.105829 -0.290727
H 0.878120 -3.179303 0.924074
H 2.558759 -1.401224 -0.375812
H -2.561375 -1.393694 -0.379275
H 4.768267 -0.535774 -1.083553
H 4.982829 1.137657 -1.048660
H -4.766806 -0.521171 -1.091003
H -4.975860 1.152967 -1.057059


%chk=000229410-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000229410

0 1
O 3.286476 1.643193 0.586018
O -3.279204 1.654408 0.578512
N 2.537919 -0.548472 0.204789
N -2.538518 -0.540546 0.201063
N 4.664086 0.139530 -0.541682
N -4.660855 0.154739 -0.549608
C -0.000074 -0.503026 -0.062534
C 0.002168 0.588989 -1.178218
C -0.001727 -1.896789 -0.775254
C 1.244541 -0.361848 0.872531
C -1.245592 -0.358046 0.870779
C 0.002881 2.063646 -0.715216
C -0.003380 -3.148654 0.133567
C 3.477130 0.480017 0.114127
C -3.473423 0.491573 0.107242
H -0.885756 0.412956 -1.819541
H 0.891185 0.411316 -1.817572
H 0.876673 -1.938098 -1.451889
H -0.880045 -1.935818 -1.452121
H 1.270790 0.648283 1.316339
H 1.156767 -1.084628 1.709697
H -1.269381 0.652209 1.314447
H -1.161332 -1.080993 1.708161
H 0.903573 2.306431 -0.124325
H -0.899325 2.308175 -0.127366
H 0.005001 2.728543 -1.599278
H -0.892155 -3.186082 0.790755
H -0.005044 -4.070860 -0.476337
H 0.885771 -3.188865 0.790068
H 2.770796 -1.477948 -0.144713
H -2.774352 -1.469549 -0.147715
H 4.845322 -0.770360 -0.959248
H 5.367317 0.869326 -0.616850
H -4.845026 -0.754987 -0.966245
H -5.361306 0.887035 -0.626385


