%chk=000245401.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245401

0 1
O -1.510368 -1.764847 0.715318
O 5.798878 -0.576302 0.424895
O 4.911755 0.720753 -1.201175
N -2.755205 0.002872 0.032873
C -0.268994 0.131231 -0.118578
C -4.011621 -0.709434 0.395061
C -2.888523 1.386361 -0.480640
C 0.975634 -0.714116 0.176447
C -1.526479 -0.634083 0.248807
C 2.257915 0.042854 -0.179899
C -4.676289 -1.324316 -0.848865
C -2.722129 2.423769 0.645660
C 3.497240 -0.811934 0.105471
C -5.984272 -2.016909 -0.480780
C -2.854224 3.843886 0.107914
C 4.747603 -0.109222 -0.339527
C 7.117689 -0.050862 0.122209
H -0.227593 1.086021 0.446639
H -0.293753 0.411628 -1.191718
H -3.764975 -1.516977 1.128541
H -4.700585 -0.004886 0.906010
H -2.143854 1.564817 -1.287609
H -3.887216 1.502785 -0.959663
H 0.914045 -1.670417 -0.383554
H 0.977739 -1.011160 1.245769
H 2.250168 0.339441 -1.250040
H 2.317003 0.991321 0.390416
H -4.859199 -0.547197 -1.614707
H -3.980483 -2.051144 -1.316390
H -3.476319 2.243470 1.437323
H -1.739227 2.293570 1.141293
H 3.562343 -1.072203 1.185002
H 3.431511 -1.789894 -0.422184
H -5.823022 -2.824021 0.244801
H -6.708325 -1.320262 -0.044037
H -6.453516 -2.466379 -1.363959
H -2.093651 4.067969 -0.649145
H -3.835481 4.018025 -0.349252
H -2.737452 4.581402 0.911774
H 7.712752 -0.380896 0.979912
H 7.082043 1.040912 0.043491
H 7.468136 -0.495221 -0.814008


%chk=000245401-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245401

0 1
O -1.545304 -1.827944 0.610869
O 5.950025 -0.851858 0.240898
O 4.972929 1.020469 -0.740221
N -2.752886 0.068258 0.031432
C -0.254002 0.116228 -0.161534
C -4.017497 -0.631581 0.362722
C -2.856588 1.459069 -0.457651
C 0.998518 -0.688856 0.236607
C -1.555697 -0.624479 0.191937
C 2.300067 0.038221 -0.161647
C -4.609978 -1.404704 -0.838976
C -2.953877 2.510919 0.676138
C 3.551903 -0.767984 0.233461
C -5.952547 -2.076371 -0.480631
C -3.132812 3.940603 0.122556
C 4.849610 -0.078660 -0.153094
C 7.281166 -0.286304 -0.085552
H -0.234836 1.110043 0.328724
H -0.232820 0.310950 -1.254641
H -3.807957 -1.341196 1.182151
H -4.745156 0.119229 0.728587
H -1.994800 1.693861 -1.106258
H -3.758358 1.531447 -1.098167
H 0.950421 -1.686800 -0.237333
H 0.979573 -0.873357 1.327962
H 2.315508 0.222033 -1.253685
H 2.343778 1.036464 0.315920
H -4.751203 -0.712941 -1.693892
H -3.875455 -2.167969 -1.155520
H -3.803004 2.253160 1.338584
H -2.041484 2.456576 1.301307
H 3.574714 -0.956645 1.324658
H 3.541851 -1.769935 -0.238820
H -5.828097 -2.785999 0.358498
H -6.710602 -1.327677 -0.180425
H -6.358173 -2.640079 -1.339907
H -2.285520 4.227221 -0.528660
H -4.059931 4.025810 -0.475293
H -3.191844 4.679863 0.941068
H 8.000875 -1.023156 0.297683
H 7.413366 0.692278 0.406251
H 7.385822 -0.157802 -1.176206


