%chk=000027343.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027343

0 1
 O   -3.027500     -0.3615000      0.1378000    
 O   -1.891600       1.646000      0.1712000    
 O    3.722400      -2.332000     -0.6945000    
 N   -6.697100     -1.4000000E-03  0.2209000    
 N    1.745200     -0.5763000     -1.8600000E-02
 C   -5.406900     -0.6724000      0.1666000    
 C   -4.273800      0.3413000      0.1748000    
 C   0.6220000      0.3140000      7.2400004E-02
 C  -0.6866000     -0.4682000      8.4200002E-02
 C   -1.908900      0.4232000      0.1406000    
 C   -7.788200     -0.9783000      0.2554000    
 C   -6.861500      0.8995000     -0.9225000    
 C    3.043100     -0.1407000     -9.8600000E-02
 C    4.044900      -1.248400     -0.2060000    
 C    3.355800       1.165800     -9.7199999E-02
 C    5.396800      -1.113300      0.3888000    
 C    4.632600       1.807300     -0.2697000    
 C    6.138500     -7.8999996E-03  0.4992000    
 C    5.840800       1.303300     -4.8000002E-03
 H   -5.284900      -1.332500       1.035300    
 H   -5.317000      -1.318600     -0.7173000    
 H   -4.298300      0.9895000     -0.7067000    
 H   -4.314400      0.9560000       1.082300    
 H   0.6830000      0.9171000      0.9870000    
 H   0.6068000       1.001400     -0.7832000    
 H  -0.7563000      -1.081800     -0.8221000    
 H  -0.7092000      -1.134200      0.9549000    
 H    1.588300      -1.579200     -2.3700001E-02
 H   -7.686800      -1.637200       1.125000    
 H   -7.815200      -1.599300     -0.6475000    
 H   -8.755100     -0.4733000      0.3574000    
 H   -6.232700       1.790700     -0.8338000    
 H   -7.888400       1.283500     -0.9601000    
 H   -6.657800      0.4042000      -1.879000    
 H    2.564600       1.909400     -1.7600000E-02
 H    5.824800      -2.050100      0.7400000    
 H    4.580700       2.833000     -0.6304000    
 H    7.124100     -0.1044000      0.9511000    
 H    6.707800       1.940800     -0.1655000    


%chk=000027343-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000027343

0 1
O -3.038767 -0.296231 0.147149
O -1.895937 1.736023 0.133682
O 3.389843 -2.437162 0.029433
N -6.774830 -0.011827 0.030546
N 1.802305 -0.455661 0.091642
C -5.428906 -0.627823 -0.001140
C -4.340611 0.440025 0.162960
C 0.641995 0.432673 0.121148
C -0.649832 -0.401741 0.124400
C -1.885990 0.483342 0.135977
C -7.825740 -0.961509 0.451624
C -7.131693 0.678564 -1.227031
C 3.115158 -0.072338 0.083770
C 4.003598 -1.292748 0.046335
C 3.490892 1.290028 0.108183
C 5.445089 -1.229810 0.028408
C 4.783954 1.871407 0.104942
C 6.321790 -0.139007 0.040788
C 6.046821 1.257042 0.075336
H -5.346651 -1.337172 0.841991
H -5.240173 -1.208841 -0.938176
H -4.331758 1.183952 -0.652528
H -4.445081 0.971185 1.124334
H 0.667723 1.082049 1.019255
H 0.644329 1.110931 -0.755716
H -0.696864 -1.058876 -0.765037
H -0.686630 -1.070330 1.005435
H 1.708558 -1.489202 0.070628
H -7.572475 -1.387855 1.438181
H -7.976049 -1.807511 -0.265842
H -8.787201 -0.426315 0.549688
H -6.385772 1.454282 -1.470481
H -8.106973 1.181946 -1.105421
H -7.206423 -0.017309 -2.101267
H 2.663250 2.010707 0.133851
H 5.897272 -2.230189 0.000333
H 4.790026 2.970359 0.128970
H 7.388363 -0.404979 0.020843
H 6.917391 1.924923 0.078905


