%chk=000013288.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000013288

0 1
 O    5.981900      -1.750100      0.2300000    
 O   -1.860800       2.019700     -0.2063000    
 N  -0.8987000     -7.8699999E-02 -3.2000002E-02
 N   0.3577000      0.4249000     -7.3299997E-02
 N   -5.827400     -0.9561000      9.9299997E-02
 C    2.716100     -0.1149000      1.3800000E-02
 C    3.683700      -1.112500      0.1345000    
 C   -3.314500      0.1854000     -3.2800000E-02
 C    3.102400       1.218000     -0.1279000    
 C    5.037500     -0.7771000      0.1134000    
 C    4.456100       1.553300     -0.1490000    
 C    5.423600      0.5559000     -2.8400000E-02
 C    1.304500     -0.4646000      3.5399999E-02
 C   -1.963500      0.7998000     -0.1052000    
 C   -4.360700      0.9328000      0.4536000    
 C   -3.479500      -1.112200     -0.4555000    
 C   -5.600100      0.3151000      0.4994000    
 C   -4.758300      -1.638400     -0.3690000    
 H    3.392200      -2.154300      0.2451000    
 H    2.371100       2.016100     -0.2240000    
 H    4.757000       2.591000     -0.2594000    
 H    6.475000      0.8303000     -4.6599999E-02
 H    1.061600      -1.537600      0.1499000    
 H   -4.247400       1.955100      0.7951000    
 H   -2.689000      -1.723600     -0.8726000    
 H  -0.9943000      -1.079200      0.1058000    
 H   -6.470800      0.8440000      0.8729000    
 H   -4.964500      -2.653700     -0.6917000    
 H    6.863100      -1.339900      0.1951000    


%chk=000013288-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000013288

0 1
O 6.065836 -1.790210 0.232451
O -1.849345 2.072807 -0.070506
N -0.899458 -0.076120 0.022272
N 0.401364 0.388831 -0.039806
N -5.975159 -0.943361 0.046108
C 2.775326 -0.100560 0.023499
C 3.773053 -1.100852 0.147539
C -3.337033 0.155587 -0.013398
C 3.155488 1.263030 -0.147479
C 5.137309 -0.742678 0.101888
C 4.519385 1.602225 -0.190439
C 5.521644 0.608848 -0.066934
C 1.364158 -0.502217 0.079018
C -1.980594 0.821298 -0.032967
C -4.436156 0.917499 0.454921
C -3.590688 -1.162988 -0.472689
C -5.719728 0.332052 0.472276
C -4.912854 -1.661548 -0.423747
H 3.509848 -2.155921 0.280692
H 2.373534 2.021852 -0.240408
H 4.816963 2.648170 -0.320695
H 6.583213 0.886041 -0.101617
H 1.158675 -1.583304 0.226153
H -4.272438 1.947182 0.785925
H -2.802996 -1.791521 -0.903942
H -1.089950 -1.078664 0.172861
H -6.586810 0.893348 0.836808
H -5.141652 -2.672312 -0.779808
H 6.993064 -1.448012 0.191625


