%chk=000163717.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000163717

0 1
 O   0.6310000       2.334900      0.6503000    
 O    4.569800     -0.8007000      0.2490000    
 O    3.781700       1.299500     -0.1173000    
 N   7.9599999E-02 -0.8633000      8.0300003E-02
 N   0.5980000      -2.091100      0.2958000    
 N   0.7068000       1.935600      -1.592500    
 C   -1.290000     -0.6896000     -1.2000001E-03
 C    1.038900      0.1096000     -3.6400001E-02
 C    2.249000     -0.5232000      0.1119000    
 C   -1.865300      0.5168000      0.3973000    
 C   -3.247000      0.6911000      0.3161000    
 C   -2.096000      -1.721800     -0.4811000    
 C    1.916100      -1.876100      0.3137000    
 C   -4.053000     -0.3411000     -0.1639000    
 C   -3.477700      -1.547600     -0.5626000    
 C   0.7775000       1.498100     -0.2673000    
 C   -3.862800       1.980800      0.7421000    
 C    3.543400      8.7899998E-02  6.5899998E-02
 H   -1.319000       1.305900      0.8883000    
 H   -1.677700      -2.670100     -0.8095000    
 H    2.573000      -2.719400      0.4736000    
 H   -5.130900     -0.2191000     -0.2312000    
 H   -4.105300      -2.350500     -0.9382000    
 H   -3.235500       2.828800      0.4463000    
 H   -4.843100       2.129700      0.2769000    
 H   -3.988900       1.996000       1.829200    
 H   0.8260000       1.301300      -2.376000    
 H   0.5305000       2.910500      -1.810900    
 H    5.443900     -0.3567000      0.2134000    


%chk=000163717-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000163717

0 1
O -0.418339 1.637854 -1.679052
O 4.517758 -1.063393 0.148699
O 4.020475 1.131820 -0.364602
N -0.004312 -0.748636 -0.055486
N 0.503802 -1.974445 0.415098
N 1.711189 2.379548 -1.113524
C -1.444034 -0.612790 -0.064353
C 0.999467 0.159374 -0.371578
C 2.225671 -0.512154 -0.061050
C -2.057028 0.538889 0.468413
C -3.467540 0.648232 0.493630
C -2.211849 -1.696490 -0.544396
C 1.846987 -1.813980 0.397145
C -4.239935 -0.433590 -0.001099
C -3.617236 -1.595702 -0.510815
C 0.699441 1.450015 -1.103188
C -4.127548 1.906137 1.029980
C 3.605247 -0.041775 -0.125123
H -1.442247 1.357907 0.855460
H -1.710979 -2.589569 -0.926780
H 2.504171 -2.617555 0.720280
H -5.333975 -0.365259 0.016698
H -4.227851 -2.424964 -0.883387
H -3.976774 2.755260 0.336690
H -5.214529 1.768100 1.160038
H -3.702640 2.202722 2.006371
H 2.661054 2.162136 -0.760080
H 1.536975 3.234115 -1.643524
H 5.437578 -0.685606 0.121532


