%chk=000131451.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131451

0 1
 O  -0.6358000     -0.6707000     -0.1991000    
 O    4.098000     -0.4047000     -0.4441000    
 O  -0.9793000       3.329900      0.4658000    
 N   -2.939300     -0.9366000     -0.1021000    
 C   -1.880700     -7.5999998E-02 -2.7899999E-02
 C   -2.743800      -2.359500     -0.3436000    
 C   -4.278800     -0.5283000      0.2986000    
 C   0.4895000      0.1114000     -0.1418000    
 C   0.4461000       1.485700      8.1299998E-02
 C   -2.037000       1.239800      0.1939000    
 C  -0.8618000       2.129100      0.2652000    
 C   -2.565900      -3.092900      0.9719000    
 C   -5.015000      7.7100001E-02 -0.8811000    
 C    1.717800     -0.5265000     -0.3188000    
 C    1.625300       2.232800      0.1292000    
 C    2.898500      0.2154000     -0.2718000    
 C    2.852100       1.592100     -4.8400000E-02
 C    4.192200      -1.764600     -2.3200000E-02
 C    5.617900      -2.053400      0.3960000    
 H   -3.616000      -2.768800     -0.8688000    
 H   -1.890700      -2.551100      -1.005300    
 H   -4.857100      -1.394400      0.6447000    
 H   -4.268100      0.1585000       1.153200    
 H   -2.992600       1.730900      0.3274000    
 H   -1.690000      -2.726400       1.517500    
 H   -3.436500      -2.977200       1.625100    
 H   -2.424600      -4.163000      0.7900000    
 H   -4.515500      0.9675000      -1.273700    
 H   -5.095900     -0.6431000      -1.702700    
 H   -6.029100      0.3644000     -0.5855000    
 H    1.717100      -1.594500     -0.5181000    
 H    1.608100       3.305000      0.3024000    
 H    3.770500       2.171800     -1.1300000E-02
 H    3.547900      -1.970400      0.8408000    
 H    3.911000      -2.419400     -0.8553000    
 H    5.729200      -3.093400      0.7156000    
 H    6.309100      -1.862700     -0.4317000    
 H    5.918600      -1.396600       1.219000    


%chk=000131451-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000131451

0 1
O -0.705701 -0.631032 0.031719
O 4.160788 -0.360217 0.075446
O -1.021547 3.540074 0.314058
N -2.985139 -0.924393 0.008821
C -1.963051 -0.000835 0.061282
C -2.728630 -2.374959 -0.160946
C -4.389632 -0.478865 0.134501
C 0.463770 0.166804 0.088547
C 0.390506 1.572729 0.193774
C -2.083683 1.384023 0.142766
C -0.930967 2.264837 0.228027
C -2.550542 -3.117307 1.181820
C -5.014934 -0.040574 -1.208874
C 1.682356 -0.540696 0.042844
C 1.615738 2.289446 0.254759
C 2.882253 0.205103 0.107521
C 2.847080 1.625788 0.214063
C 4.267753 -1.830088 -0.033983
C 5.756143 -2.165968 -0.043479
H -3.585078 -2.795759 -0.720801
H -1.829614 -2.508814 -0.784027
H -4.964918 -1.321648 0.560145
H -4.442627 0.343537 0.871266
H -3.067197 1.856026 0.131019
H -1.669991 -2.728754 1.720670
H -3.437155 -2.993661 1.830104
H -2.403671 -4.199035 1.005593
H -4.458782 0.805379 -1.647685
H -5.007341 -0.870783 -1.937899
H -6.063540 0.274907 -1.058414
H 1.663139 -1.629761 -0.037623
H 1.552423 3.379633 0.333699
H 3.796095 2.167114 0.261478
H 3.752988 -2.299829 0.829431
H 3.771787 -2.164637 -0.968400
H 5.897489 -3.259186 -0.122788
H 6.258875 -1.684793 -0.899472
H 6.239957 -1.816607 0.884338


