%chk=000220326.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220326

0 1
O -1.388344 -2.953383 -0.589589
N -2.522854 -0.624405 -0.236883
N -1.296389 -0.141870 -0.241669
N 2.049269 -0.680663 -0.090315
N 0.967270 -0.130728 -0.403878
C -3.623045 0.285385 -0.031780
C -4.912545 -0.281333 -0.016922
C -3.437834 1.666983 0.143124
C -6.014761 0.552874 0.174841
C -4.556321 2.480477 0.333696
C 3.240362 0.140163 -0.116884
C -5.842200 1.930318 0.350098
C 4.311385 -0.349654 0.655077
C 3.387492 1.310914 -0.881601
C -0.227332 -0.930978 -0.405451
C 5.523995 0.341078 0.656744
C 4.609641 1.986247 -0.872604
C 5.675907 1.505017 -0.105798
C -0.289797 -2.410056 -0.621390
C 0.948325 -3.187035 -0.895087
H -5.057625 -1.351887 -0.151512
H -2.433471 2.096690 0.130327
H -7.017119 0.124159 0.187920
H -4.421684 3.553932 0.470609
H -2.739228 -1.643959 -0.360941
H -6.707963 2.572717 0.499216
H 4.187154 -1.257514 1.245590
H 2.550362 1.687116 -1.471934
H 6.356066 -0.029207 1.254415
H 4.730005 2.893171 -1.464074
H 6.626092 2.036726 -0.101344
H 1.631164 -3.178003 -0.026471
H 0.719454 -4.237947 -1.127076
H 1.527667 -2.771846 -1.733753


%chk=000220326-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000220326

0 1
O -1.501790 -2.902255 -0.319746
N -2.489462 -0.560378 -0.171259
N -1.250675 -0.063300 -0.159096
N 2.154674 -0.784606 -0.251263
N 1.012093 -0.140609 -0.196171
C -3.609722 0.306077 -0.106419
C -4.900752 -0.282497 -0.126051
C -3.457268 1.714256 -0.024668
C -6.041885 0.543504 -0.063617
C -4.607259 2.524906 0.037143
C 3.301141 0.081720 -0.219026
C -5.901913 1.948875 0.018260
C 4.557961 -0.576218 -0.277228
C 3.245614 1.502394 -0.134930
C -0.174824 -0.908424 -0.222203
C 5.752294 0.174372 -0.252216
C 4.441898 2.243057 -0.110567
C 5.697989 1.585692 -0.168796
C -0.313737 -2.392121 -0.304512
C 0.874044 -3.321644 -0.369665
H -5.005898 -1.372173 -0.189327
H -2.449981 2.138522 -0.011706
H -7.038627 0.089908 -0.078800
H -4.495429 3.612855 0.100258
H -2.581217 -1.608980 -0.230649
H -6.789726 2.588134 0.066636
H 4.570744 -1.669536 -0.341206
H 2.265435 1.986835 -0.090846
H 6.720226 -0.336576 -0.297427
H 4.404055 3.336490 -0.046267
H 6.624263 2.170802 -0.149241
H 1.529071 -3.184733 0.508157
H 0.499542 -4.356371 -0.424568
H 1.512219 -3.084480 -1.238282


