%chk=000002327.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002327

0 1
 O    1.423800      -1.827700      0.5906000    
 O   -5.467000      0.1872000      -1.727900    
 O    4.058500      -2.041200     -0.1915000    
 O   -2.810700      -1.118400     -0.7587000    
 O    5.529800      0.2437000     -0.7193000    
 N  -0.7707000      0.6937000     -0.2629000    
 N   -2.075600      0.8841000      0.1607000    
 N   -4.440000     -0.2558000       1.781700    
 C   0.1345000      0.6931000      0.8783000    
 C    1.572400      0.5547000      0.4538000    
 C   -4.400400      0.2784000      0.4225000    
 C    2.148300     -0.7024000      0.3281000    
 C   -3.026600     -8.0200002E-02 -0.1360000    
 C    2.305500       1.704600      0.1910000    
 C   -5.528300     -0.3340000     -0.4046000    
 C    3.481500     -0.8119000     -6.7400001E-02
 C    3.638500       1.595200     -0.2046000    
 C    4.226500      0.3370000     -0.3338000    
 H  -0.1278000     -0.1143000       1.574500    
 H   2.3300000E-02   1.622300       1.454600    
 H   -4.511800       1.368800      0.4394000    
 H  -0.5486000       1.477800     -0.8760000    
 H    1.857900       2.690000      0.2860000    
 H   -2.298200       1.733700      0.6704000    
 H   -6.505700     -7.2200000E-02  1.4200000E-02
 H   -5.464400      -1.426400     -0.4633000    
 H    4.207200       2.498300     -0.4092000    
 H   -3.669200      0.1252000       2.329000    
 H   -4.317800      -1.267700       1.767600    
 H    1.995700      -2.601800      0.4486000    
 H   -4.661900     -0.1604000      -2.147500    
 H    4.982100      -1.920100     -0.4726000    
 H    5.883800       1.138900     -0.8588000    


%chk=000002327-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000002327

0 1
O 1.544740 -1.797271 0.815817
O -5.373090 0.157474 -1.875021
O 4.090861 -2.046411 -0.153105
O -2.873785 -0.979857 -0.991124
O 5.572866 0.131176 -0.911259
N -0.735560 0.753168 -0.139851
N -2.097373 0.898168 0.194632
N -4.604613 -0.432597 1.757488
C 0.181019 0.740120 1.033257
C 1.614879 0.625500 0.557240
C -4.464056 0.247350 0.455268
C 2.230341 -0.645647 0.431743
C -3.075395 -0.009827 -0.201365
C 2.363327 1.771001 0.189955
C -5.577227 -0.267822 -0.492389
C 3.550013 -0.751920 -0.061435
C 3.684237 1.677420 -0.308016
C 4.269416 0.400647 -0.435055
H -0.085962 -0.130418 1.654866
H 0.071690 1.662803 1.657065
H -4.602815 1.334291 0.615909
H -0.442294 1.392771 -0.891472
H 1.905822 2.760685 0.304452
H -2.389681 1.689817 0.787934
H -6.544806 0.152293 -0.178414
H -5.624262 -1.375075 -0.416935
H 4.241726 2.579506 -0.585082
H -4.077198 -0.020939 2.532274
H -4.489633 -1.450110 1.702260
H 2.106389 -2.593043 0.619801
H -4.578055 -0.338152 -2.209569
H 5.008141 -1.998432 -0.525287
H 6.044936 0.955526 -1.177683


