%chk=000226326.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000226326

0 1
 O   5.5199999E-02   2.557600     -2.8600000E-02
 O    2.709200       1.892700      0.3662000    
 O   -2.733300     -0.4250000      7.0900001E-02
 O   -2.322100       1.594800     -0.9537000    
 O   0.7588000      -3.681800     -0.1356000    
 O    2.836700      -3.064500      0.2117000    
 N    1.625700      -2.790200      3.1199999E-02
 C  -0.5115000      0.2390000     -0.1998000    
 C   0.4344000       1.247300     -1.5200000E-02
 C    1.775000      0.9180000      0.1843000    
 C  -0.1168000      -1.098900     -0.1848000    
 C    1.223800      -1.428200      1.4500000E-02
 C    2.169800     -0.4198000      0.1991000    
 C   -1.916500      0.5608000     -0.4093000    
 C   -4.142900     -0.2244000     -7.7799998E-02
 C   -4.874800      -1.412400      0.5091000    
 C  -0.3221000       3.134000       1.219300    
 C    3.351200       2.401100     -0.8014000    
 H  -0.8546000      -1.881600     -0.3450000    
 H    3.221600     -0.6468000      0.3580000    
 H   -4.437300      0.6905000      0.4481000    
 H   -4.385900     -0.1266000      -1.141500    
 H   -5.957400      -1.292100      0.4118000    
 H   -4.574800      -2.337000      4.9000001E-03
 H   -4.626000      -1.533200       1.568500    
 H   0.5300000       3.151200       1.906100    
 H   -1.153700       2.583100       1.669700    
 H  -0.6436000       4.163200       1.037400    
 H    2.618600       2.848700      -1.480400    
 H    3.901500       1.605400      -1.313500    
 H    4.060300       3.174300     -0.4933000    


%chk=000226326-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000226326

0 1
O 0.122172 2.506354 -0.102598
O 2.873710 1.778113 0.009135
O -2.773765 -0.500288 -0.066132
O -2.420510 1.598826 0.881327
O 0.711212 -3.813691 0.710474
O 2.904891 -3.203381 0.570926
N 1.642765 -2.929381 0.577181
C -0.515500 0.166086 0.293094
C 0.478136 1.176897 0.133356
C 1.862265 0.811001 0.109996
C -0.128969 -1.188209 0.417358
C 1.240044 -1.510779 0.419923
C 2.245113 -0.532936 0.268135
C -1.964416 0.532684 0.403007
C -4.251016 -0.281667 0.050490
C -4.924501 -1.514700 -0.540926
C 0.170703 3.410210 1.077903
C 2.923614 2.544165 -1.263537
H -0.878758 -1.974207 0.524903
H 3.301838 -0.810621 0.268022
H -4.493619 -0.132638 1.118397
H -4.503756 0.646153 -0.493362
H -6.022384 -1.403319 -0.480283
H -4.646725 -1.646273 -1.600346
H -4.637739 -2.426161 0.010652
H 1.170516 3.372855 1.547346
H -0.623944 3.118135 1.784340
H -0.029927 4.414580 0.677437
H 1.962757 3.050990 -1.453287
H 3.172573 1.863654 -2.099142
H 3.731720 3.276751 -1.122887


