%chk=000018231.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000018231

1 1
 O  -0.1902000       1.340900      0.3005000    
 O    2.448000      -2.367800       1.071000    
 O    2.239100      -1.928700      -1.149600    
 O    1.277500       2.362900      -1.161800    
 N   -2.154600     -0.6965000     -2.0900000E-02
 C  -0.7847000     -0.9897000      0.4738000    
 C   0.1977000      2.6400000E-02 -0.1011000    
 C   -2.200300     -0.7415000      -1.553900    
 C   -3.158500      -1.724200      0.5181000    
 C   -2.608900      0.6980000      0.4303000    
 C    1.602600     -0.2265000      0.4447000    
 C    2.118400      -1.579500      1.7500000E-02
 C   0.6202000       2.351200     -0.1299000    
 C   0.5936000       3.475100      0.8612000    
 H  -0.8149000     -0.9382000       1.569300    
 H  -0.5333000      -2.014300      0.1770000    
 H   0.2374000     -3.0200001E-02  -1.194300    
 H   -1.676900      0.1203000      -1.974500    
 H   -1.750700      -1.682200      -1.884900    
 H   -3.250000     -0.6979000      -1.861700    
 H   -3.155000      -1.661100       1.610200    
 H   -4.151400      -1.493000      0.1213000    
 H   -2.838000      -2.717000      0.1888000    
 H   -2.278800      0.8768000       1.458000    
 H   -2.293900       1.461900     -0.2844000    
 H   -3.705200      0.7061000      0.4169000    
 H    1.598000     -0.1600000       1.540400    
 H    2.343700      0.5070000      0.1121000    
 H   0.9681000       3.125900       1.826700    
 H  -0.4251000       3.858900      0.9587000    
 H    1.238900       4.284800      0.5088000    
 H    2.785900      -3.242200      0.7823000    


%chk=000018231-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000018231

1 1
O 0.490653 1.400151 0.951308
O 3.057192 -2.587364 0.310132
O 0.973613 -2.534428 -0.714439
O -0.218084 2.356759 -1.052599
N -2.144775 -0.569417 -0.095041
C -0.884091 -0.676385 0.806951
C 0.395249 0.045595 0.336729
C -1.794842 -0.785047 -1.573120
C -3.098997 -1.680668 0.351602
C -2.848075 0.777949 0.069673
C 1.656243 -0.709845 0.805628
C 1.829293 -2.019809 0.050626
C 0.251432 2.509143 0.099077
C 0.634875 3.798674 0.767695
H -1.176632 -0.307691 1.805562
H -0.674914 -1.755482 0.862345
H 0.422694 0.157970 -0.759879
H -1.316001 0.125341 -1.963722
H -1.114031 -1.646691 -1.655483
H -2.729770 -0.972802 -2.123141
H -3.274644 -1.593366 1.435070
H -4.051059 -1.573219 -0.189745
H -2.646187 -2.656539 0.119463
H -3.113016 0.919360 1.128834
H -2.179202 1.575871 -0.278526
H -3.760592 0.772153 -0.546523
H 1.633153 -0.914512 1.892829
H 2.547152 -0.080722 0.637344
H 1.696190 4.019159 0.546834
H 0.528974 3.730876 1.861062
H 0.031212 4.626399 0.366369
H 3.175687 -3.445713 -0.182316


