%chk=000257214.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257214

0 1
O 0.336573 2.363217 0.636852
O 2.998668 0.979843 2.513875
O 1.397649 3.638914 2.155488
N 1.461999 0.377129 0.849603
C -0.617884 0.594345 -0.637862
C -0.791451 -0.832222 -1.076228
C 0.350734 1.010343 0.199210
C -1.611768 1.566096 -1.153632
C -1.409212 -1.694926 -0.003235
C 2.001019 -0.920356 0.500858
C 2.083162 1.240248 1.786968
C -1.748434 1.753105 -2.538776
C -2.424147 2.291733 -0.267615
C 1.309613 2.575124 1.636187
C -0.840084 -2.938122 0.308794
C -2.575876 -1.280896 0.658018
C 2.017212 -1.932518 1.471745
C 2.542428 -1.122023 -0.779333
C -2.698583 2.652057 -3.029480
C -3.374023 3.186407 -0.766663
C -1.429947 -3.754636 1.278164
C -3.158841 -2.099220 1.627965
C -3.514970 3.366250 -2.146374
C 2.577717 -3.170194 1.142905
C 3.088880 -2.369282 -1.088780
C -2.587904 -3.337595 1.940798
C 3.106912 -3.391203 -0.132561
H 0.173803 -1.258127 -1.423018
H -1.452686 -0.875237 -1.974662
H -1.109299 1.207229 -3.229671
H -2.299278 2.167875 0.807775
H 0.064128 -3.270770 -0.198752
H -3.027841 -0.320153 0.411962
H 1.603828 -1.755753 2.465323
H 2.546134 -0.317681 -1.514003
H -2.801300 2.798532 -4.103599
H -4.001981 3.749133 -0.077151
H -0.985089 -4.719275 1.515923
H -4.062497 -1.772487 2.140312
H -4.255035 4.064771 -2.532187
H 2.601889 -3.964672 1.889492
H 3.512533 -2.542372 -2.078277
H -3.044983 -3.973730 2.695482
H 3.541933 -4.358799 -0.380440


%chk=000257214-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000257214

0 1
O 0.363862 2.361365 0.767599
O 3.002421 0.840849 2.650539
O 1.509409 3.543108 2.439081
N 1.439582 0.346918 0.903662
C -0.599654 0.613805 -0.623251
C -0.751051 -0.854589 -1.031481
C 0.364559 1.025544 0.263532
C -1.609751 1.582162 -1.155837
C -1.469090 -1.712552 0.021994
C 2.045532 -0.906302 0.511783
C 2.051100 1.152280 1.900472
C -1.973513 1.523074 -2.532219
C -2.258192 2.549360 -0.335015
C 1.341202 2.495937 1.810648
C -1.023189 -3.033129 0.279149
C -2.612716 -1.233472 0.711919
C 2.147237 -1.951063 1.454577
C 2.626432 -1.026729 -0.773089
C -2.933779 2.404402 -3.071560
C -3.226269 3.422325 -0.873562
C -1.703697 -3.860038 1.201616
C -3.292182 -2.057009 1.636826
C -3.569252 3.358173 -2.243698
C 2.818907 -3.140973 1.096764
C 3.284166 -2.224419 -1.126341
C -2.841455 -3.374489 1.885485
C 3.381627 -3.283610 -0.192244
H 0.215923 -1.325172 -1.269838
H -1.348971 -0.887629 -1.960464
H -1.478996 0.805653 -3.197363
H -2.004390 2.616476 0.725780
H -0.136889 -3.415432 -0.242169
H -2.976530 -0.217848 0.521466
H 1.707881 -1.831023 2.448715
H 2.571162 -0.189088 -1.477067
H -3.182922 2.348001 -4.136961
H -3.713771 4.154198 -0.220177
H -1.344302 -4.878649 1.387263
H -4.174648 -1.672444 2.160802
H -4.319483 4.039637 -2.659404
H 2.902364 -3.953123 1.826316
H 3.732017 -2.323665 -2.120801
H -3.369327 -4.012887 2.602665
H 3.902337 -4.207830 -0.464714


