%chk=000232922.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000232922

0 1
O -0.117023 2.580256 0.280477
N -0.254777 0.301385 0.782878
N 3.018182 1.627315 -0.208581
C 1.940841 -0.330481 0.326328
C 0.625500 -0.924292 0.711209
C 1.802462 1.058037 0.140111
C 3.299999 -0.662771 0.091035
C -1.719096 0.174430 0.862870
C 0.402489 1.489148 0.368773
C 3.958072 0.583448 -0.245759
C -2.359699 -0.115994 -0.509306
C 4.059280 -1.853889 0.116752
C 5.339260 0.629365 -0.549354
C -3.850541 -0.244833 -0.368324
C 5.404087 -1.792119 -0.180866
C 6.037924 -0.558336 -0.511525
C -4.446186 -1.510117 -0.257178
C -4.654755 0.905508 -0.338721
C -5.832998 -1.621582 -0.121734
C -6.039866 0.787912 -0.202358
C -6.632249 -0.474828 -0.093919
H 0.247524 -1.652699 -0.035326
H 0.652870 -1.419585 1.705444
H -2.124806 1.132784 1.272564
H -1.975168 -0.627472 1.589624
H 3.180769 2.598875 -0.392966
H -2.107070 0.701015 -1.219490
H -1.922534 -1.029877 -0.956286
H 3.573082 -2.793432 0.369881
H 5.819527 1.569963 -0.800360
H 6.011599 -2.695487 -0.167770
H 7.104314 -0.571170 -0.737742
H -3.831689 -2.407042 -0.278010
H -4.197948 1.890884 -0.422673
H -6.291311 -2.605571 -0.037958
H -6.659878 1.682948 -0.180886
H -7.711188 -0.563699 0.011141


%chk=000232922-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000232922

0 1
O -0.152803 2.502273 0.135343
N -0.247723 0.147135 0.512822
N 3.027111 1.606592 -0.179981
C 2.003176 -0.391567 0.253248
C 0.663197 -1.029941 0.537079
C 1.819120 0.976490 0.085979
C 3.407035 -0.666265 0.089024
C -1.696771 0.061160 0.690170
C 0.404579 1.367046 0.229425
C 4.029265 0.619777 -0.184448
C -2.459009 -0.277334 -0.628579
C 4.224694 -1.827883 0.136332
C 5.418210 0.746625 -0.402987
C -3.963039 -0.296142 -0.407865
C 5.608541 -1.697896 -0.082221
C 6.198393 -0.425688 -0.348619
C -4.665677 -1.515545 -0.231065
C -4.689304 0.921554 -0.326991
C -6.057669 -1.521968 0.017476
C -6.079766 0.920015 -0.079156
C -6.769660 -0.303012 0.095090
H 0.367880 -1.773216 -0.231252
H 0.619825 -1.529792 1.525858
H -2.040850 1.044731 1.058023
H -1.930933 -0.694515 1.464136
H 3.156213 2.603443 -0.340379
H -2.184104 0.489176 -1.376585
H -2.112365 -1.256726 -1.009980
H 3.785034 -2.810364 0.340242
H 5.878613 1.719287 -0.607877
H 6.249325 -2.585750 -0.048112
H 7.279411 -0.360305 -0.513980
H -4.120428 -2.465907 -0.296346
H -4.160738 1.872917 -0.467771
H -6.585525 -2.473932 0.146138
H -6.625369 1.869011 -0.025230
H -7.848888 -0.305486 0.285032


