%chk=000020086.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020086

0 1
 O    1.408800      -1.222000     -0.1635000    
 O   -1.374700      -1.124400      0.1544000    
 O    3.268300      -1.795200       1.076200    
 O   -3.258500      -1.832900     -0.9737000    
 N    5.317000       1.525100     -0.6337000    
 N   -5.151800       1.824700      0.1134000    
 C    5.593000       2.601300      0.3074000    
 C    6.698400       1.737700     -0.2261000    
 C   -6.524200       2.022500     -0.3308000    
 C   -6.219100       1.621400       1.082900    
 C    4.748700      0.3736000      5.6200001E-02
 C   -4.637800      0.5454000     -0.3594000    
 C    3.314300      0.1336000     -0.4055000    
 C   -3.213600      0.3277000      0.1431000    
 C    2.699800      -1.071800      0.2701000    
 C   -2.655500      -1.004000     -0.3060000    
 C   0.6938000      -2.321000      0.3880000    
 C  -0.7069000      -2.341700     -0.1931000    
 H    5.500000       3.603800     -9.0700001E-02
 H    5.311100       2.497500       1.346900    
 H    7.160900       1.022700      0.4421000    
 H    7.350100       2.158200     -0.9803000    
 H   -6.969100       1.288600     -0.9903000    
 H   -6.813900       3.048600     -0.5145000    
 H   -6.301800       2.379800       1.850900    
 H   -6.473400      0.6200000       1.404000    
 H    4.769900      0.4454000       1.152800    
 H    5.339800     -0.5181000     -0.1955000    
 H   -4.613000      0.5575000      -1.458000    
 H   -5.258400     -0.3198000     -8.6000003E-02
 H    2.695800       1.006900     -0.1673000    
 H    3.291100     -3.6400001E-02  -1.488400    
 H   -2.557400       1.119700     -0.2365000    
 H   -3.197800      0.3450000       1.239300    
 H    1.210100      -3.257200      0.1488000    
 H   0.6404000      -2.196300       1.475800    
 H   -1.265400      -3.194900      0.2071000    
 H  -0.6545000      -2.411500      -1.285800    


%chk=000020086-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000020086

0 1
O 1.514770 -1.334937 -0.312914
O -1.429066 -1.130620 -0.004612
O 3.133736 -1.903356 1.261610
O -3.150734 -1.682946 -1.472238
N 5.670956 1.168102 -0.478986
N -5.277069 1.827758 -0.032409
C 5.398608 2.631237 -0.214228
C 6.689522 1.987274 0.271081
C -6.772089 1.946233 0.114893
C -5.888227 1.846921 1.350083
C 4.884685 0.206846 0.341715
C -4.777483 0.504781 -0.497087
C 3.582627 -0.124803 -0.405405
C -3.302759 0.364728 -0.084875
C 2.771571 -1.199682 0.290202
C -2.672112 -0.909416 -0.610631
C 0.629007 -2.378287 0.270696
C -0.686678 -2.330831 -0.478153
H 5.402417 3.277699 -1.097047
H 4.650595 2.888434 0.549767
H 6.791557 1.824654 1.353371
H 7.628723 2.169066 -0.260037
H -7.389201 1.070424 -0.130676
H -7.197926 2.909711 -0.181028
H -5.673404 2.737857 1.947928
H -5.921900 0.903066 1.913324
H 4.650801 0.590135 1.364139
H 5.487358 -0.710176 0.465213
H -4.860580 0.473604 -1.597631
H -5.368655 -0.353449 -0.095253
H 2.953062 0.774473 -0.536682
H 3.829510 -0.472818 -1.426997
H -2.732785 1.227692 -0.480289
H -3.185604 0.402563 1.013624
H 1.113116 -3.364931 0.147617
H 0.495847 -2.185053 1.349218
H -1.291516 -3.231260 -0.263585
H -0.536179 -2.261194 -1.569420


