%chk=000227884.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227884

0 1
O -2.208468 1.401335 1.249310
N -2.539519 -0.359087 -0.163723
C 4.009285 -0.057431 -0.245202
C 2.511146 0.074480 -0.041519
C -4.026382 -0.306658 -0.063451
C -0.256492 0.348821 0.323252
C 4.313745 -1.080355 -1.346461
C 4.696395 -0.430733 1.073853
C 1.887100 1.313040 -0.257536
C 1.736708 -1.023542 0.366844
C 0.510535 1.452940 -0.070157
C 0.359831 -0.888617 0.549493
C -1.727738 0.534950 0.536063
C -4.546248 -1.642085 0.481143
C -4.621943 0.006838 -1.440724
H 4.419239 0.933100 -0.575911
H -4.291449 0.520180 0.656045
H 3.995295 -2.090702 -1.067407
H 5.387942 -1.124108 -1.557427
H 3.801808 -0.822155 -2.280638
H 4.454276 0.289398 1.864667
H 5.785874 -0.446534 0.961248
H 4.390351 -1.420219 1.430854
H 2.475885 2.175630 -0.565984
H 2.214021 -1.985294 0.546955
H -2.143735 -1.051057 -0.788931
H 0.029327 2.421448 -0.219675
H -0.230641 -1.742604 0.880508
H -5.634102 -1.612237 0.611120
H -4.320155 -2.482028 -0.183274
H -4.107357 -1.868188 1.460981
H -4.234984 0.955854 -1.832825
H -5.712340 0.099610 -1.382007
H -4.399810 -0.769289 -2.179985


%chk=000227884-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000227884

0 1
O -2.257125 1.804569 0.348622
N -2.594018 -0.472966 0.040859
C 4.075614 -0.058656 -0.186455
C 2.556728 0.097464 -0.082565
C -4.070559 -0.370853 0.097232
C -0.288500 0.396719 0.092524
C 4.470577 -0.972829 -1.377825
C 4.690349 -0.582884 1.139109
C 1.941138 1.364257 -0.251364
C 1.719839 -1.017124 0.190696
C 0.542657 1.515304 -0.161207
C 0.320434 -0.873061 0.278151
C -1.775338 0.637348 0.173281
C -4.658878 -1.699644 0.611050
C -4.652147 0.036293 -1.278335
H 4.501485 0.946594 -0.379341
H -4.289036 0.440730 0.815235
H 4.082378 -1.998731 -1.236034
H 5.570712 -1.037259 -1.469211
H 4.064877 -0.586517 -2.330054
H 4.432273 0.075608 1.987698
H 5.792264 -0.633913 1.061162
H 4.322206 -1.598900 1.374544
H 2.568270 2.241240 -0.453921
H 2.166295 -2.006366 0.347337
H -2.188333 -1.371123 -0.227154
H 0.064290 2.493480 -0.276728
H -0.284500 -1.753564 0.529276
H -5.757542 -1.623839 0.690112
H -4.433521 -2.532786 -0.083869
H -4.256616 -1.955085 1.607516
H -4.205416 0.988566 -1.610555
H -5.747330 0.171693 -1.210036
H -4.446125 -0.739060 -2.040251


