%chk=000157302.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000157302

0 1
 O   -4.019100     -0.4759000     -0.8209000    
 O    1.403900      -2.168300      -1.067100    
 O    1.605300      -2.095200       1.117700    
 O    2.770900       1.200700      0.8992000    
 O    2.568800       1.127900      -1.285500    
 N    1.124600      -1.662600      4.4599999E-02
 N    2.080900       1.042800     -0.1346000    
 C   -2.038500      0.2572000      0.2729000    
 C   0.2290000     -0.5564000      9.0200000E-02
 C   -1.136700     -0.8058000      0.2252000    
 C   0.6931000      0.7561000      3.1999999E-03
 C   -1.574600       1.569900      0.1859000    
 C  -0.2087000       1.819200      5.1199999E-02
 C   -3.498800     -9.6000005E-03  0.4179000    
 H   -1.502800      -1.828200      0.2932000    
 H   -2.265800       2.407800      0.2202000    
 H   0.1377000       2.847800     -1.5600000E-02
 H   -3.675500     -0.7690000       1.187800    
 H   -4.046600      0.8935000      0.7081000    
 H   -4.966400     -0.6483000     -0.6852000    


%chk=000157302-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000157302

0 1
O -3.823194 -1.298917 0.242289
O 1.913086 -1.684385 -1.168326
O 0.804165 -2.765380 0.514745
O 2.930362 0.220535 0.666718
O 2.583805 2.148595 -0.512674
N 1.045999 -1.737579 -0.220257
N 2.178569 1.055904 0.039689
C -2.071289 0.354594 0.177609
C 0.194303 -0.534339 -0.003590
C -1.191894 -0.748337 0.094586
C 0.720897 0.777623 0.000298
C -1.542028 1.669044 0.152575
C -0.152859 1.881489 0.069522
C -3.569888 0.137592 0.282317
H -1.598652 -1.762137 0.094140
H -2.213085 2.533577 0.209811
H 0.273333 2.888346 0.069282
H -3.935733 0.586752 1.231752
H -4.074573 0.662225 -0.558263
H -4.790622 -1.481604 0.326177


