%chk=000121277.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121277

0 1
 O   0.8465000     -0.5715000     -0.9288000    
 O  -4.9300000E-02 -0.3584000       1.220300    
 N   -2.576500     -0.5818000      4.2100001E-02
 C   -5.058000      0.9523000      0.2165000    
 C   -3.732700       1.489400      0.7450000    
 C   -5.045800     -0.5719000      0.1980000    
 C   -2.547100      0.8867000     -1.0100000E-02
 C   -3.818600      -1.109400     -0.5400000    
 C   -1.412000      -1.141400     -0.6436000    
 C  -0.1589000     -0.6440000      3.5300002E-02
 C    2.064000     -0.1195000     -0.4139000    
 C    2.960800      -1.044300      7.7299997E-02
 C    2.325600       1.234000     -0.4154000    
 C    4.176800     -0.5941000      0.5915000    
 C    3.541600       1.684100      9.8600000E-02
 C    2.668000      -2.508700      7.5599998E-02
 C    1.348500       2.228600     -0.9505000    
 C    4.467200      0.7700000      0.6022000    
 H   -5.885200       1.314700      0.8366000    
 H   -5.226900       1.329400     -0.7997000    
 H   -3.715000       2.581300      0.6516000    
 H   -3.644000       1.258000       1.814000    
 H   -5.049600     -0.9499000       1.228400    
 H   -5.958400     -0.9430000     -0.2819000    
 H   -1.647400       1.305900      0.4495000    
 H   -2.564500       1.236500      -1.051400    
 H   -3.827500      -2.203600     -0.4652000    
 H   -3.889800     -0.8549000      -1.605800    
 H   -1.403000      -2.235200     -0.5779000    
 H   -1.404500     -0.8501000      -1.701200    
 H    4.907700      -1.293300      0.9893000    
 H    3.781600       2.744000      0.1157000    
 H    2.294000      -2.828900     -0.9026000    
 H    3.565800      -3.101200      0.2831000    
 H    1.922800      -2.747500      0.8410000    
 H    1.831300       3.186900      -1.171300    
 H   0.5548000       2.409100     -0.2192000    
 H   0.9015000       1.877400      -1.886400    
 H    5.413600       1.120700       1.003400    


%chk=000121277-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000121277

0 1
O 0.946038 -0.185160 -0.931712
O -0.096505 0.214527 1.132239
N -2.675651 -0.301618 -0.142038
C -5.468089 0.304478 0.559259
C -4.278100 0.986370 1.271037
C -5.038719 -1.078040 0.016943
C -3.046014 1.052924 0.347400
C -3.790403 -0.950815 -0.878846
C -1.430895 -0.311734 -0.916381
C -0.178808 -0.060612 -0.076423
C 2.270280 0.019707 -0.401181
C 2.869734 -0.998001 0.378678
C 2.930566 1.214243 -0.776624
C 4.208072 -0.787114 0.794694
C 4.267367 1.381539 -0.339387
C 2.110426 -2.254106 0.754832
C 2.223226 2.267981 -1.606014
C 4.902415 0.390446 0.441481
H -6.325686 0.198981 1.250263
H -5.808092 0.941533 -0.283972
H -4.548472 2.010877 1.591342
H -4.007203 0.412241 2.177473
H -4.799015 -1.749054 0.864134
H -5.858777 -1.544775 -0.562211
H -2.186827 1.467485 0.900664
H -3.266702 1.736653 -0.517023
H -3.455894 -1.953802 -1.206187
H -4.061963 -0.370509 -1.801891
H -1.302479 -1.300830 -1.395269
H -1.412922 0.434580 -1.754648
H 4.702563 -1.556443 1.398892
H 4.806638 2.295355 -0.614387
H 1.593148 -2.690299 -0.119191
H 2.790432 -3.015783 1.171480
H 1.338494 -2.030981 1.514752
H 2.908487 3.095159 -1.856314
H 1.360255 2.694203 -1.060195
H 1.829259 1.842470 -2.546593
H 5.937220 0.534324 0.771024


