%chk=000231796.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231796

0 1
O 1.154660 -0.484347 0.128266
O 0.101834 1.554294 0.087767
N -1.084334 -0.452646 -0.061411
C -2.448870 0.150948 -0.001972
C 2.478216 0.184620 0.144605
C -3.078226 -0.117916 1.369013
C -3.292628 -0.439003 -1.135437
C 3.383578 -0.915879 0.671698
C 2.798806 0.632787 -1.270265
C 0.046105 0.338948 0.059754
H -2.337273 1.262270 -0.150814
H 2.398871 1.046382 0.844687
H -0.998580 -1.464102 -0.027739
H -4.072653 0.337353 1.439913
H -3.193858 -1.187396 1.574058
H -2.468249 0.306161 2.176989
H -2.818791 -0.275532 -2.112167
H -4.282177 0.031538 -1.169114
H -3.448711 -1.517547 -1.024725
H 4.422801 -0.576469 0.740545
H 3.065053 -1.248028 1.668400
H 3.359865 -1.800956 0.021838
H 3.821018 1.017052 -1.351252
H 2.116055 1.435798 -1.588323
H 2.690387 -0.187527 -1.990213


%chk=000231796-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000231796

0 1
O 1.132210 -0.575664 -0.059275
O 0.035193 1.478226 0.375666
N -1.133651 -0.467746 -0.226566
C -2.488017 0.119883 -0.126606
C 2.459593 0.090550 0.162875
C -2.982245 0.147627 1.339574
C -3.445218 -0.658821 -1.050469
C 3.406885 -1.031222 0.596245
C 2.889098 0.805076 -1.127306
C -0.001097 0.257707 0.057571
H -2.402219 1.164590 -0.479958
H 2.318588 0.832862 0.970855
H -1.023648 -1.460805 -0.437375
H -3.968584 0.642605 1.405053
H -3.080452 -0.877835 1.742061
H -2.271156 0.709319 1.969192
H -3.096384 -0.636186 -2.098169
H -4.455677 -0.216419 -1.011206
H -3.532268 -1.716048 -0.731853
H 4.410678 -0.617996 0.803531
H 3.035764 -1.525937 1.509996
H 3.500826 -1.791391 -0.199489
H 3.876395 1.282354 -0.985296
H 2.161847 1.590535 -1.392907
H 2.966435 0.085538 -1.962043


