%chk=000239603.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239603

0 1
O -0.741826 -1.718036 -0.402472
O 1.815285 -0.814983 -0.013852
N -2.899530 -0.052548 -0.041232
C -0.482754 -0.384965 -0.110350
C 0.824060 0.138333 0.010458
C -1.598610 0.485606 -0.046736
C 1.028384 1.517064 0.156281
C -1.381494 1.876517 0.080841
C -0.083172 2.366701 0.183039
C -0.369898 -2.634738 0.663252
C 3.188200 -0.358104 0.072746
H 2.024775 1.931815 0.243550
H -2.227819 2.554795 0.119067
H 0.075497 3.441161 0.288556
H -2.969793 -1.016536 -0.353888
H -3.632129 0.534598 -0.410087
H -0.922277 -2.396098 1.574431
H 0.713403 -2.587539 0.824976
H -0.668057 -3.602322 0.248279
H 3.363704 0.138504 1.030983
H 3.426505 0.291641 -0.774341
H 3.740548 -1.304366 0.008600


%chk=000239603-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239603

0 1
O -0.842465 -1.738327 -0.314236
O 1.827667 -0.840691 0.001299
N -2.905016 -0.010738 -0.278681
C -0.521715 -0.375364 -0.090767
C 0.798734 0.124289 0.046904
C -1.631723 0.522431 -0.107099
C 1.024920 1.514745 0.211252
C -1.396493 1.918315 0.047476
C -0.082156 2.393765 0.210069
C -0.354126 -2.706646 0.690515
C 3.205992 -0.352003 0.052544
H 2.036801 1.910429 0.328472
H -2.243111 2.614248 0.042123
H 0.089137 3.469038 0.333456
H -2.986120 -1.010835 -0.445498
H -3.721779 0.587917 -0.333692
H -0.715045 -2.433766 1.701322
H 0.747082 -2.746740 0.682308
H -0.779956 -3.676036 0.386878
H 3.421075 0.156109 1.012824
H 3.418309 0.338043 -0.786562
H 3.832990 -1.251681 -0.038809


