%chk=000237607.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000237607

0 1
O 1.323453 -0.532462 -0.271147
O -2.156149 -1.234426 -1.434192
O -0.988644 1.667503 2.336901
N 0.964595 0.880292 1.491748
N -1.150107 0.230777 0.502890
C 5.612629 -0.414295 0.211973
C 4.113105 -0.548257 -0.073353
C 6.441524 -1.246243 -0.777368
C 3.280090 0.281529 0.913532
C 7.938051 -1.120796 -0.503186
C 1.804624 0.141392 0.620667
C -2.574230 0.210868 0.365941
C -0.484040 0.959971 1.479408
C -3.121769 -0.587190 -0.689111
C -3.451775 0.916387 1.191900
C -4.495875 -0.664509 -0.894908
C -4.836540 0.835683 0.980942
C -5.353620 0.055747 -0.048734
C -2.595697 -2.071211 -2.530176
H 5.835342 -0.736467 1.247554
H 5.919710 0.647865 0.154137
H 3.801708 -1.611889 -0.021627
H 3.885787 -0.230844 -1.111884
H 6.138987 -2.310685 -0.721120
H 6.223333 -0.925496 -1.815272
H 3.582834 1.349087 0.857876
H 3.497227 -0.040948 1.954343
H 8.280586 -0.083358 -0.590100
H 8.196287 -1.468299 0.503650
H 8.521172 -1.717696 -1.214061
H 1.380992 1.447749 2.243781
H -0.608349 -0.344099 -0.183440
H -3.062240 1.536574 2.009005
H -4.912147 -1.269190 -1.694394
H -5.504185 1.393343 1.635807
H -6.429458 -0.002218 -0.206607
H -3.210017 -2.895096 -2.156123
H -3.122073 -1.471670 -3.278216
H -1.637122 -2.439024 -2.921638


%chk=000237607-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000237607

0 1
O 1.140705 -1.122554 0.091111
O -2.120641 -1.552984 -1.060625
O -0.836531 2.056987 2.078831
N 0.981973 0.730710 1.504548
N -1.149130 0.245541 0.580969
C 5.553172 -0.617627 0.253156
C 4.058437 -0.390695 -0.061623
C 6.437149 -0.624663 -1.015098
C 3.182022 -0.367209 1.216941
C 7.931327 -0.857368 -0.703514
C 1.694955 -0.296577 0.884310
C -2.536662 0.350105 0.306102
C -0.420507 1.066119 1.409167
C -3.070190 -0.629875 -0.590080
C -3.400725 1.333441 0.843503
C -4.435900 -0.623300 -0.936362
C -4.770709 1.336340 0.492220
C -5.288981 0.366484 -0.390882
C -2.565579 -2.585522 -1.995066
H 5.673967 -1.582883 0.788324
H 5.915870 0.170908 0.945776
H 3.683923 -1.192076 -0.725784
H 3.934472 0.563976 -0.611385
H 6.074774 -1.412565 -1.706136
H 6.314417 0.338786 -1.550311
H 3.486852 0.467593 1.877361
H 3.350500 -1.307097 1.778819
H 8.327303 -0.064844 -0.040575
H 8.083417 -1.827591 -0.193852
H 8.540667 -0.861440 -1.625786
H 1.479396 1.369824 2.129984
H -0.628034 -0.524310 0.112410
H -2.989710 2.079574 1.526121
H -4.839671 -1.375334 -1.620835
H -5.429049 2.102629 0.914725
H -6.350645 0.372177 -0.659928
H -3.328520 -3.240810 -1.531861
H -2.972660 -2.135961 -2.921428
H -1.663451 -3.169511 -2.227846


