%chk=000183806.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183806

0 1
O 0.049285 1.285956 -1.724392
O 1.117773 -1.580305 -1.694128
O 2.417557 2.119261 0.893635
O 5.625594 -1.256045 -0.012366
N -3.083683 -0.437587 0.591902
C -3.696674 -1.576479 -0.171556
C -4.109064 -0.069757 1.625016
C -5.234164 -1.459401 -0.066868
C -5.500995 -0.493222 1.101816
C -2.739546 0.712207 -0.306926
C -1.767389 1.671163 0.403300
C -0.392176 1.039029 0.630712
C 0.419223 0.916859 -0.634919
C 1.770908 0.293210 -0.436525
C 2.114467 -0.937079 -1.026593
C 2.776886 0.939591 0.305205
C 3.395009 -1.507051 -0.914691
C 4.072361 0.425805 0.450832
C 4.351622 -0.795952 -0.176329
H -3.340696 -2.509457 0.314686
H -3.350187 -1.608498 -1.219745
H -4.070874 1.003336 1.882985
H -3.848387 -0.633926 2.545218
H -5.696448 -2.443352 0.108147
H -5.665968 -1.073196 -1.004528
H -6.080723 0.381680 0.765894
H -6.093133 -0.974096 1.896051
H -2.241708 0.315226 -1.222425
H -3.632211 1.272505 -0.655181
H -1.659376 2.586407 -0.214912
H -2.185880 1.993536 1.375695
H -0.522040 0.026275 1.079928
H 0.185891 1.623514 1.377646
H 3.629343 -2.451762 -1.381754
H 4.844547 0.934145 1.015856
H 1.422022 -2.425562 -2.116899
H 3.175672 2.552513 1.368704
H 5.783064 -2.119389 -0.475091


%chk=000183806-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000183806

0 1
O -0.012987 1.143253 -1.781913
O 1.127672 -1.602938 -1.774446
O 2.434379 2.128714 0.956377
O 5.724205 -1.276476 -0.045200
N -3.097604 -0.412734 0.660668
C -3.638222 -1.626428 -0.014204
C -4.133543 -0.109182 1.692058
C -5.181116 -1.400916 -0.150734
C -5.530225 -0.477417 1.062627
C -2.825091 0.729233 -0.262217
C -1.818050 1.730118 0.349685
C -0.448614 1.082903 0.625541
C 0.399638 0.872225 -0.621397
C 1.779799 0.271059 -0.424677
C 2.139383 -0.943552 -1.064773
C 2.787282 0.914295 0.340509
C 3.439140 -1.496117 -0.957844
C 4.096160 0.398749 0.460569
C 4.410276 -0.806930 -0.196863
H -3.447723 -2.503724 0.635886
H -3.126248 -1.798375 -0.975700
H -4.069152 0.946500 2.006900
H -3.947171 -0.738275 2.583487
H -5.743157 -2.351573 -0.133327
H -5.410257 -0.893903 -1.105448
H -6.072806 0.425566 0.731627
H -6.169424 -0.994020 1.800663
H -2.389953 0.323626 -1.192066
H -3.756068 1.276680 -0.546932
H -1.700234 2.578726 -0.350632
H -2.224873 2.135974 1.296761
H -0.618711 0.087977 1.091889
H 0.154135 1.665088 1.347708
H 3.682535 -2.447467 -1.449650
H 4.872603 0.909841 1.039114
H 1.476294 -2.412985 -2.222022
H 3.213733 2.527470 1.416214
H 5.863896 -2.114885 -0.550836


