%chk=000133895.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133895

0 1
 O    5.539500      0.2894000      0.9482000    
 O   -1.001200       2.580900      -1.066800    
 O   -1.682800      -2.018200      -1.287400    
 O   -1.785900      -2.580800      0.8320000    
 N    1.971700      0.6267000     -2.6699999E-02
 N   -2.344300      0.5663000      0.5020000    
 N   -4.156600     -0.6191000      0.1003000    
 N   -2.078200      -1.787200     -0.1083000    
 C    3.357400       1.039800      0.2293000    
 C    4.189300     -0.1259000      0.7718000    
 C    1.917100     -0.4785000     -0.9942000    
 C    4.142800      -1.326300     -0.1700000    
 C    2.700100      -1.693600     -0.4926000    
 C    1.177900       1.760800     -0.4990000    
 C  -0.3041000       1.402800     -0.6547000    
 C  -0.9297000      0.9095000      0.6559000    
 C   -2.843600     -0.6459000      0.1573000    
 C   -3.375100       1.428300      0.6789000    
 C   -4.494300      0.6711000      0.4239000    
 H    3.381600       1.850700      0.9689000    
 H    3.828600       1.442800     -0.6779000    
 H    3.803900     -0.4164000       1.757300    
 H    2.309100     -0.1645000      -1.970600    
 H   0.8948000     -0.8315000      -1.148800    
 H    4.663500      -2.180400      0.2787000    
 H    4.687500      -1.094300      -1.094300    
 H    2.681300      -2.485300      -1.250100    
 H    2.215700      -2.098300      0.4053000    
 H    1.560600       2.151900      -1.451700    
 H    1.255100       2.593200      0.2139000    
 H  -0.4539000      0.6781000      -1.460800    
 H  -0.8885000       1.693800       1.422200    
 H  -0.4209000      2.7100001E-02   1.056600    
 H    6.036700     -0.4702000       1.296600    
 H   -1.861100       2.307700      -1.428700    
 H   -3.244600       2.464400      0.9588000    
 H   -5.526000      0.9895000      0.4572000    


%chk=000133895-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000133895

0 1
O 5.363166 0.531241 1.264573
O -1.057520 2.623351 -1.100250
O -1.115631 -1.772747 -0.656935
O -3.031416 -2.959367 -0.248079
N 1.972848 0.593917 -0.280261
N -2.260809 0.495814 0.606398
N -4.301595 -0.539649 0.466179
N -2.348994 -1.872469 -0.231544
C 3.307795 1.072114 0.163476
C 4.065382 -0.055006 0.882461
C 2.091833 -0.553122 -1.223660
C 4.220830 -1.280271 -0.037818
C 2.834659 -1.728423 -0.558754
C 1.131452 1.691955 -0.803311
C -0.373566 1.348305 -0.811207
C -0.809895 0.796158 0.563727
C -2.969883 -0.670145 0.275287
C -3.224703 1.409372 1.021215
C -4.469031 0.756765 0.928797
H 3.178501 1.921483 0.857361
H 3.938445 1.423452 -0.691401
H 3.490627 -0.348081 1.788236
H 2.635423 -0.242024 -2.153780
H 1.081060 -0.883426 -1.517094
H 4.718729 -2.111248 0.500995
H 4.873792 -0.996981 -0.887829
H 2.947117 -2.551875 -1.288087
H 2.217772 -2.110750 0.276744
H 1.416236 2.003699 -1.837352
H 1.261996 2.578067 -0.153793
H -0.607935 0.596230 -1.589216
H -0.608693 1.559472 1.335376
H -0.223982 -0.104994 0.792280
H 5.911250 -0.165923 1.705777
H -1.926299 2.447349 -1.539974
H -2.950021 2.408045 1.350076
H -5.455540 1.148114 1.163889


