%chk=000226156.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000226156

0 1
O 1.155202 -2.148429 1.293255
O -0.338569 1.317359 -0.749167
O 2.172714 -1.849461 -0.708285
N -1.137092 -0.401543 0.570135
C 1.270196 0.065972 0.584900
C 2.322679 1.021304 0.071918
C -0.128407 0.421002 0.032997
C 2.695531 1.017912 -1.279870
C 2.921378 1.923031 0.964218
C 1.622825 -1.370117 0.245128
C -2.538805 -0.308369 0.280301
C 3.666781 1.913728 -1.734501
C 3.891784 2.815847 0.501404
C 4.265731 2.812633 -0.846368
C -3.387056 -1.239249 0.917290
C -3.068403 0.657722 -0.590897
C -4.759457 -1.190078 0.673004
C -4.445359 0.686928 -0.819815
C -5.294231 -0.230651 -0.193418
C 1.358239 -3.583340 1.188221
H 1.219347 0.156923 1.710485
H 2.229606 0.314296 -1.972919
H 2.633642 1.938078 2.013406
H -0.866371 -1.157802 1.214370
H 3.953873 1.911105 -2.785329
H 4.355264 3.517447 1.193070
H 5.020514 3.510821 -1.203984
H -2.985394 -1.989484 1.592873
H -2.413711 1.381039 -1.087735
H -5.418535 -1.906600 1.162722
H -4.858301 1.436090 -1.496126
H -6.365090 -0.199119 -0.378712
H 0.693871 -3.981122 0.414926
H 1.089822 -3.940384 2.188013
H 2.405481 -3.797392 0.947188


%chk=000226156-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000226156

0 1
O 0.987789 -2.124620 1.317142
O -0.323347 1.340002 -0.936079
O 2.289521 -1.846799 -0.599981
N -1.144056 -0.322920 0.509961
C 1.278652 0.134702 0.551377
C 2.364295 1.071418 0.051766
C -0.143876 0.454268 -0.059053
C 2.693505 1.157330 -1.323258
C 3.064389 1.877180 0.982171
C 1.610768 -1.343551 0.312957
C -2.545380 -0.294865 0.253247
C 3.710574 2.034450 -1.755418
C 4.083023 2.756637 0.550530
C 4.408849 2.836107 -0.822047
C -3.352094 -1.222604 0.967352
C -3.150401 0.605704 -0.663665
C -4.746349 -1.253722 0.766982
C -4.549034 0.561296 -0.851934
C -5.355101 -0.360605 -0.145862
C 1.190110 -3.592286 1.202409
H 1.168984 0.251625 1.646159
H 2.155131 0.543656 -2.050724
H 2.812853 1.820027 2.049012
H -0.820122 -1.039017 1.172662
H 3.957253 2.095124 -2.821114
H 4.616439 3.375091 1.280911
H 5.197395 3.516999 -1.162045
H -2.886010 -1.915745 1.679948
H -2.528180 1.317070 -1.209283
H -5.356304 -1.973645 1.323704
H -5.010187 1.258024 -1.560873
H -6.438733 -0.383490 -0.302146
H 0.743047 -3.966936 0.266421
H 0.688451 -4.017503 2.082866
H 2.267845 -3.822303 1.208602


