%chk=000198872.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198872

0 1
O 1.008515 -1.440274 -0.379771
O 3.890966 0.402936 0.050145
N 0.462662 -0.150616 -0.081274
N 2.361087 -1.353860 -0.356894
C -0.972887 -0.086733 -0.048272
C 1.449482 0.707202 0.115053
C -1.627856 1.073687 -0.492490
C -1.686992 -1.200359 0.425470
C 1.403632 2.129511 0.455315
C 2.788136 -0.079748 -0.066301
C -3.023063 1.115244 -0.440144
C -3.081176 -1.136257 0.464935
C -3.747897 0.017419 0.037285
H -1.065314 1.922543 -0.881141
H -1.157217 -2.099669 0.752001
H 0.547272 2.410512 1.084567
H 2.330937 2.416448 0.998336
H 1.389850 2.759040 -0.452855
H -3.548632 2.009677 -0.779134
H -3.650282 -1.993002 0.831048
H -4.837622 0.059800 0.072619


%chk=000198872-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000198872

0 1
O 1.076837 -1.563986 -0.446983
O 3.906414 0.514885 -0.035893
N 0.426367 -0.108184 -0.037197
N 2.430945 -1.368665 -0.434624
C -0.982360 -0.061238 -0.026112
C 1.454917 0.686621 0.118971
C -1.662713 1.079554 -0.530215
C -1.702249 -1.171682 0.485287
C 1.458297 2.123633 0.530060
C 2.767281 -0.029995 -0.125650
C -3.071778 1.108897 -0.497693
C -3.110473 -1.130164 0.497048
C -3.799181 0.008182 0.013424
H -1.098247 1.917180 -0.951919
H -1.153883 -2.041791 0.856732
H 0.585411 2.390799 1.148463
H 2.399559 2.315501 1.073272
H 1.474331 2.778275 -0.362745
H -3.601296 1.986255 -0.883312
H -3.671000 -1.985457 0.887787
H -4.893578 0.034882 0.029797


