%chk=000114241.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000114241

0 1
 O    1.353900      0.7583000     -0.6311000    
 O    4.240200      -1.263500      0.2706000    
 O   -3.998700      -1.596500      0.3249000    
 O   -2.192100      -2.689000     -0.2767000    
 N   0.1136000       3.196700      2.8000001E-02
 N   -2.780800      -1.622200      2.3700001E-02
 C   3.0099999E-02  0.7831000     -0.3070000    
 C    2.074300     -0.4322000     -0.3200000    
 C  -0.6042000       1.980800      2.3200000E-02
 C  -0.6911000     -0.4109000     -0.3075000    
 C    3.525900     -7.8699999E-02 -5.9799999E-02
 C   -2.046500     -0.4071000      2.2299999E-02
 C   -1.959500       1.984600      0.3530000    
 C   -2.680600      0.7907000      0.3525000    
 C    5.615500     -0.9942000      0.5039000    
 H    1.687900     -0.9288000      0.5805000    
 H    2.008500      -1.135300      -1.159100    
 H  -0.2146000      -1.343000     -0.5969000    
 H    3.593700      0.6436000      0.7628000    
 H    3.960700      0.3903000     -0.9508000    
 H   -2.465200       2.911300      0.6123000    
 H   -3.734700      0.8317000      0.6149000    
 H    1.096900       3.200500     -0.2088000    
 H  -0.3530000       4.061000      0.2685000    
 H    6.083500     -0.5815000     -0.3950000    
 H    6.112800      -1.934900      0.7554000    
 H    5.733900     -0.3015000       1.342800    


%chk=000114241-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000114241

0 1
O 1.382637 0.847098 0.082945
O 4.368826 -1.265620 0.083850
O -4.215790 -1.571630 -0.071597
O -2.259409 -2.755121 -0.061221
N 0.082635 3.165238 0.111048
N -2.920005 -1.636551 -0.049053
C -0.018829 0.745032 0.055693
C 2.154412 -0.407267 0.072211
C -0.687358 2.019640 0.071546
C -0.743361 -0.450052 0.016269
C 3.628164 -0.006108 0.105635
C -2.161301 -0.385751 -0.008091
C -2.109332 2.041079 0.045960
C -2.848685 0.848127 0.006404
C 5.816240 -1.063407 0.119359
H 1.899141 -1.019707 0.958074
H 1.932406 -0.984680 -0.845612
H -0.267486 -1.433298 0.003197
H 3.851746 0.574210 1.027365
H 3.878444 0.621447 -0.777475
H -2.628307 3.006006 0.057731
H -3.941064 0.850537 -0.013332
H 1.096179 3.075530 0.127748
H -0.343603 4.087122 0.124051
H 6.167516 -0.484969 -0.761393
H 6.266290 -2.067788 0.100328
H 6.130294 -0.535816 1.044962


