%chk=000268186.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268186

0 1
O 3.529444 -1.686043 0.318927
O -1.296054 -1.004932 -1.728913
N 2.653519 -0.026026 -0.977154
N -2.755111 -0.247025 -0.162674
C 0.338141 -1.720728 0.768685
C 3.752854 0.898589 -0.572610
C 1.437835 0.700058 -1.433252
C -3.202105 0.839932 -1.082115
C -3.094283 0.003647 1.262269
C 3.286980 1.878524 0.520255
C 0.910121 1.618663 -0.318612
C -2.665138 2.209507 -0.637148
C -2.539187 1.355770 1.742803
C 1.996246 2.608989 0.119949
C -3.009443 2.496562 0.829689
C 1.273515 -2.046343 -0.414002
C -1.124504 -2.069880 0.414520
C 2.560036 -1.256837 -0.291466
C -1.689421 -1.065017 -0.567745
C 0.780028 -2.467478 2.027823
H 0.392161 -0.612911 0.971968
H 4.088409 1.446507 -1.478483
H 4.618022 0.294453 -0.210034
H 0.651868 -0.022911 -1.765204
H 1.711578 1.292711 -2.334045
H -4.313750 0.838121 -1.094570
H -2.859626 0.603561 -2.118232
H -2.711406 -0.826298 1.898902
H -4.204999 -0.009322 1.352450
H 4.089947 2.609197 0.728278
H 3.127643 1.323708 1.465834
H 0.587443 0.995443 0.546199
H -0.002012 2.153822 -0.664982
H -3.077130 3.000138 -1.290971
H -1.558163 2.242002 -0.778878
H -1.432544 1.324230 1.765514
H -2.861411 1.542205 2.784226
H 1.633723 3.220867 0.966482
H 2.208778 3.319071 -0.702683
H -2.545176 3.449297 1.147360
H -4.102283 2.639097 0.938366
H 0.757838 -1.848373 -1.384555
H 1.520513 -3.127569 -0.433086
H -1.731853 -2.145542 1.339578
H -1.175033 -3.078320 -0.049970
H 0.619102 -3.548252 1.945883
H 1.861066 -2.329166 2.198395
H 0.257717 -2.116897 2.921830


%chk=000268186-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000268186

0 1
O 3.428620 -1.791426 0.646466
O -1.482850 -1.060515 -1.889359
N 2.645574 0.044558 -0.551151
N -2.703952 -0.220411 -0.096726
C 0.165284 -1.878956 0.760681
C 3.893423 0.794061 -0.270988
C 1.659512 0.787805 -1.367811
C -3.288259 0.841218 -0.953901
C -3.099686 -0.132768 1.326119
C 3.588038 2.144515 0.414562
C 1.308189 2.144523 -0.707625
C -2.942757 2.248073 -0.415200
C -2.748699 1.256444 1.915839
C 2.582333 2.972631 -0.420099
C -3.364736 2.391987 1.065947
C 1.228714 -2.026971 -0.377590
C -1.253241 -2.258626 0.218991
C 2.513441 -1.256828 -0.067881
C -1.833801 -1.150094 -0.661251
C 0.540817 -2.741922 1.986539
H 0.137819 -0.815311 1.080537
H 4.421427 0.975679 -1.231826
H 4.526985 0.148244 0.357904
H 0.748005 0.192089 -1.519721
H 2.101329 0.980670 -2.369688
H -4.391040 0.709867 -0.970187
H -2.902070 0.686717 -1.973879
H -2.605049 -0.923734 1.908033
H -4.196900 -0.292171 1.403018
H 4.533115 2.704100 0.552389
H 3.169489 1.949964 1.421477
H 0.767401 1.952763 0.241679
H 0.621594 2.700260 -1.375576
H -3.448189 3.009032 -1.039907
H -1.852007 2.413956 -0.511523
H -1.646243 1.368067 1.943805
H -3.112842 1.306772 2.959912
H 2.324077 3.913314 0.102315
H 3.055156 3.258932 -1.382830
H -3.060046 3.378333 1.462960
H -4.471406 2.344409 1.138321
H 0.778964 -1.744885 -1.343503
H 1.514727 -3.092667 -0.441938
H -1.914284 -2.527354 1.060693
H -1.159748 -3.155212 -0.420039
H 0.458090 -3.818379 1.742197
H 1.584664 -2.548512 2.288973
H -0.125083 -2.533439 2.845645


