%chk=000072548.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072548

0 1
 O    2.979600     -0.6021000      0.1517000    
 O   -4.091800      -3.088900     -0.2061000    
 O   -4.566100       1.204100       1.115300    
 O   -2.491900       2.625500     -0.2375000    
 O    6.469400     -0.5474000     -6.5700002E-02
 O    5.060600      -2.171800      0.3769000    
 N   -4.071200     -0.2543000     -0.6564000    
 N   -1.469900      0.5538000      0.1566000    
 N  -0.2107000       1.013400     -1.8500000E-02
 N    5.281800     -0.9570000      9.4999999E-02
 C   -5.277100      -1.049200     -0.6457000    
 C   -5.142000      -2.255000      0.2661000    
 C    2.116900      0.4151000     -2.2600001E-02
 C    2.739000       1.583000     -0.3169000    
 C    4.214100     -6.7400001E-02 -3.8400002E-02
 C    4.120100       1.273800     -0.3291000    
 C   -3.849400      0.7813000      0.2224000    
 C   0.7040000      0.1095000      0.1276000    
 C   -2.515600       1.433700      2.5400000E-02
 H   -5.447600      -1.369200      -1.678900    
 H   -6.117300     -0.4249000     -0.3250000    
 H   -6.066300      -2.839900      0.2672000    
 H   -4.915200      -1.962200       1.296300    
 H   -3.357400     -0.4846000      -1.341900    
 H    2.282000       2.544400     -0.5027000    
 H    4.940100       1.949800     -0.5265000    
 H   0.4554000     -0.9397000      0.3737000    
 H   -1.601800     -0.4291000      0.3752000    
 H   -3.274900      -2.561200     -0.1984000    


%chk=000072548-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000072548

0 1
O 3.655321 0.082584 0.937290
O -6.455436 -2.176170 -1.668312
O -3.243861 -0.975985 1.398302
O -2.251026 0.700034 -1.632296
O 7.113398 0.794048 0.330209
O 6.081853 -0.233580 2.114557
N -4.553852 -0.173252 -0.384985
N -0.997762 -0.094429 0.223394
N 0.234101 0.286578 -0.247338
N 6.067636 0.351076 0.962162
C -5.858337 -0.582972 0.162041
C -6.236684 -2.028867 -0.224919
C 2.589385 0.400499 0.066983
C 3.089073 1.040232 -1.078854
C 4.809935 0.541317 0.298557
C 4.507210 1.129516 -0.929084
C -3.377892 -0.397091 0.269564
C 1.275905 0.017997 0.521630
C -2.156085 0.141493 -0.507317
H -6.626805 0.109776 -0.221723
H -5.813524 -0.500986 1.263612
H -7.203732 -2.283284 0.239120
H -5.466411 -2.733258 0.148296
H -4.485766 0.330143 -1.277119
H 2.481743 1.391419 -1.909486
H 5.229905 1.562327 -1.615639
H 1.217589 -0.485197 1.503449
H -1.146924 -0.575220 1.132108
H -5.582158 -2.155249 -2.135100


