%chk=000276726.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276726

0 1
O 1.075922 1.783938 0.856856
O 3.070551 -0.048508 -1.317605
O 2.746920 -1.185730 0.651142
O 1.517313 2.914455 -2.101770
O -3.900051 -2.673199 0.248945
N -0.441754 0.421295 -0.349031
N -2.713055 1.308909 0.355678
N -0.997888 -1.803776 -0.440138
N -4.379797 -0.458506 0.603441
N -4.906517 1.788596 1.199717
C 2.759167 1.237833 -0.780670
C 2.441027 1.286327 0.734175
C 1.439489 1.636101 -1.501762
C 0.357643 1.649514 -0.380120
C 2.542772 -0.041140 1.492168
C 3.668312 -1.032595 -0.432512
C 5.059612 -0.613711 0.003313
C 3.567968 -2.330578 -1.211704
C -1.790211 0.304231 0.029071
C -0.003473 -0.932858 -0.598639
C -2.123650 -1.066383 -0.052642
C -3.481539 -1.548205 0.258896
C -4.022656 0.795700 0.700004
H 3.600933 1.908311 -1.059277
H 3.022496 2.082610 1.253015
H 1.209793 0.958870 -2.360627
H -0.299964 2.551516 -0.416789
H 3.350446 -0.023430 2.245619
H 1.576393 -0.287098 1.988492
H 1.798302 3.604971 -1.460066
H 5.087665 0.363765 0.492269
H 5.481971 -1.343555 0.708469
H 5.737052 -0.558593 -0.860794
H 3.295336 -2.139384 -2.262171
H 4.502768 -2.900929 -1.203887
H 2.780320 -2.980731 -0.790288
H 1.033094 -1.145677 -0.856237
H -2.387192 2.199172 0.725294
H -4.970416 2.640842 0.652719
H -5.837203 1.423730 1.421448


%chk=000276726-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000276726

0 1
O 0.652492 2.169652 0.149739
O 2.567676 -0.149848 -1.040898
O 1.929110 -0.524794 1.261756
O 2.132734 3.299354 -2.256478
O -3.362394 -2.912562 -0.646831
N -0.328254 0.584729 -1.394277
N -1.760386 0.714690 0.651289
N -1.152443 -1.376723 -2.244366
N -3.331193 -1.118110 0.876232
N -3.259442 0.590741 2.479635
C 2.693804 1.300820 -0.861137
C 2.088601 1.835420 0.464958
C 1.770027 1.920030 -1.945205
C 0.373224 1.869668 -1.276177
C 2.186926 0.862672 1.647919
C 2.796825 -0.995066 0.163008
C 4.287851 -0.975913 0.553756
C 2.272696 -2.375369 -0.211086
C -1.315129 0.132989 -0.524267
C -0.277689 -0.385649 -2.433796
C -1.819033 -1.070716 -1.037827
C -2.872840 -1.802723 -0.306464
C -2.801282 0.015621 1.303743
H 3.739387 1.634929 -1.000876
H 2.567556 2.793969 0.747241
H 1.843970 1.373478 -2.894227
H -0.270917 2.693161 -1.636383
H 3.186113 0.970500 2.119859
H 1.420719 1.103595 2.402855
H 1.936878 3.882876 -1.477804
H 4.678954 0.045602 0.705994
H 4.437662 -1.550743 1.483721
H 4.878828 -1.444366 -0.250600
H 2.820022 -2.765899 -1.084535
H 2.400731 -3.068505 0.636751
H 1.202159 -2.312393 -0.461935
H 0.422545 -0.314428 -3.260102
H -1.205934 1.457603 1.086026
H -3.066140 1.556420 2.732801
H -3.996515 0.081385 2.961989


