%chk=000064959.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000064959

0 1
 O    2.214700     -0.4092000     -0.9822000    
 O    1.210500       2.161700       1.320600    
 O    3.372100       2.332500     -0.3176000    
 O    4.202400      -2.342500     -0.5651000    
 O   -4.204000      -1.971000      0.4325000    
 O   -3.677100       2.540800     -0.5803000    
 N   4.0000002E-03 -0.4057000     -0.1201000    
 N   -1.771300       1.254800     -0.3944000    
 N   -1.255500      -2.201600      0.3356000    
 N   -3.929700      0.2903000     -7.5400002E-02
 C    1.200700      0.3991000     -0.3547000    
 C    1.829400      0.9589000      0.9123000    
 C    3.268600       1.150100      0.4757000    
 C    3.501200     -6.3800000E-02 -0.4183000    
 C    4.030300      -1.270100      0.3447000    
 C   -1.292500      1.2000001E-03 -0.1445000    
 C  -2.5400000E-02  -1.749100      0.1752000    
 C   -2.044800      -1.104800      0.1349000    
 C   -3.477000      -1.015500      0.1875000    
 C   -3.156500       1.443900     -0.3664000    
 H   0.9224000       1.186600      -1.065100    
 H    1.773800      0.2382000       1.736300    
 H    3.967400       1.245200       1.311600    
 H    4.162400      0.1616000      -1.262800    
 H    3.335800      -1.602400       1.122600    
 H    4.997500      -1.051100      0.8063000    
 H   0.8732000      -2.343900      0.2656000    
 H    1.308000       2.809200      0.6018000    
 H    4.294300       2.399600     -0.6188000    
 H   -1.137800       2.022200     -0.5905000    
 H    3.337400      -2.524900     -0.9704000    
 H   -4.937000      0.4255000     -5.4600000E-02


%chk=000064959-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000064959

0 1
O 2.358025 -0.769975 -0.841742
O 0.918069 2.399018 0.358746
O 3.301395 2.318466 -0.666201
O 4.405218 -2.405263 0.318525
O -4.483378 -1.843819 0.084812
O -3.301610 2.635526 0.820387
N 0.008373 -0.615966 -0.531921
N -1.588815 1.174569 0.172948
N -1.458953 -2.369986 -0.640232
N -3.806399 0.373774 0.423005
C 1.235935 0.164115 -0.742607
C 1.586565 1.114225 0.443201
C 3.127004 1.235818 0.318284
C 3.572523 -0.144187 -0.207824
C 4.065014 -1.106025 0.885819
C -1.242614 -0.118273 -0.174751
C -0.189542 -1.996791 -0.819980
C -2.135725 -1.204535 -0.237232
C -3.544882 -1.006800 0.080737
C -2.931456 1.475867 0.494467
H 1.153281 0.752834 -1.680001
H 1.300037 0.648923 1.400552
H 3.607489 1.499702 1.279225
H 4.336735 -0.057398 -1.001418
H 3.299832 -1.201310 1.686617
H 5.003870 -0.730160 1.329038
H 0.631395 -2.629100 -1.141349
H 1.497425 2.989207 -0.201372
H 4.236724 2.632352 -0.698241
H -0.883694 1.929769 0.253814
H 3.601633 -2.765106 -0.138118
H -4.781974 0.586331 0.654809


