%chk=000075333.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000075333

0 1
 O   0.7654000       1.086800      0.9940000    
 O    1.526600      0.5973000      -1.147700    
 O    5.627400      -1.270300     -0.7318000    
 N    3.012500      0.8125000      0.6208000    
 C   -3.375700      -1.298100     -2.7799999E-02
 C   -2.541000     -6.8999999E-03 -6.8999999E-03
 C   -3.777000      -1.633500      -1.480600    
 C   -4.651700      -1.105900      0.8200000    
 C   -2.634300      -2.531000      0.5370000    
 C   -1.263300     -6.5499999E-02  0.4905000    
 C   -3.111600       1.145200     -0.4869000    
 C  -0.5060000       1.105800      0.5089000    
 C   -2.354500       2.316300     -0.4686000    
 C   -1.051600       2.296600      2.9300001E-02
 C    1.762100      0.8104000      3.7999999E-02
 C    4.233800      0.5605000     -0.1082000    
 C    4.609000     -0.9068000     -0.1381000    
 C    3.729800      -1.913400      0.5582000    
 H   -4.337400      -2.574800      -1.527600    
 H   -4.414000     -0.8623000      -1.927200    
 H   -2.892400      -1.740800      -2.119600    
 H   -5.306400     -0.3245000      0.4193000    
 H   -5.243500      -2.028200      0.8566000    
 H   -4.402300     -0.8298000       1.851500    
 H   -3.274900      -3.421000      0.4979000    
 H   -1.733800      -2.769500     -4.1400000E-02
 H   -2.352900      -2.395300       1.588000    
 H  -0.7965000     -0.9644000      0.8737000    
 H   -4.122100       1.184200     -0.8789000    
 H   -2.779000       3.243600     -0.8419000    
 H  -0.4672000       3.212700      4.1000001E-02
 H    4.119100      0.9115000      -1.138200    
 H    5.033000       1.115800      0.3907000    
 H    3.075100      0.9888000       1.619000    
 H    4.189000      -2.904200      0.4897000    
 H    3.630200      -1.656800       1.615700    
 H    2.750800      -1.953900      7.5400002E-02


%chk=000075333-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000075333

0 1
O 0.938703 1.177923 -0.121994
O 1.474768 -1.138287 -0.379497
O 6.252511 -0.913773 0.632990
N 3.088525 0.560078 -0.369119
C -3.536488 -1.284880 -0.353575
C -2.658427 -0.031176 -0.117713
C -4.546424 -0.996342 -1.505431
C -4.323370 -1.610243 0.952332
C -2.700163 -2.530925 -0.740865
C -1.245766 -0.078518 -0.239697
C -3.269640 1.203240 0.232904
C -0.485995 1.090262 -0.008213
C -2.494188 2.360417 0.457322
C -1.089472 2.315390 0.338652
C 1.799783 0.072838 -0.300675
C 4.234815 -0.322466 -0.578655
C 5.012322 -0.714571 0.700940
C 4.210330 -0.891342 1.977506
H -5.192977 -1.878029 -1.674199
H -5.199386 -0.136770 -1.271328
H -4.014443 -0.771531 -2.447944
H -4.974665 -0.771683 1.257180
H -4.962867 -2.499960 0.799767
H -3.629305 -1.821428 1.786297
H -3.374578 -3.391932 -0.901675
H -2.132991 -2.370135 -1.676067
H -1.983837 -2.809406 0.053556
H -0.733654 -1.003903 -0.498468
H -4.358798 1.266053 0.332922
H -2.982288 3.303594 0.725899
H -0.465565 3.198051 0.505567
H 3.855398 -1.263511 -1.024203
H 4.948634 0.125014 -1.291913
H 3.219954 1.568833 -0.289694
H 4.845533 -1.326060 2.764034
H 3.817182 0.083213 2.324347
H 3.331531 -1.536934 1.792512


