%chk=000125175.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125175

0 1
 O   -3.058000     -4.6900000E-02  0.7735000    
 O   -2.238300     -0.1524000      -1.386200    
 O    4.427400      -1.990000       1.140500    
 O    5.173400       1.935500      -1.145900    
 O   -4.604100      -2.402200      0.2173000    
 O   -4.709800       2.204500      0.1029000    
 N    4.480700      0.1842000      0.2578000    
 N   -4.348600     -9.0700001E-02  0.2023000    
 C    2.116200      0.7578000      0.4292000    
 C    1.688500     -0.7053000      0.2518000    
 C    1.086600       1.530500       1.264600    
 C  -0.7367000     -3.8600001E-02  0.4909000    
 C   0.2851000     -0.8142000     -0.3405000    
 C  -0.3172000       1.420200      0.6733000    
 C    3.501100      0.8410000       1.068500    
 C   -2.077700     -8.7899998E-02 -0.1746000    
 C    4.841700      -1.142500      0.3680000    
 C    5.205900      0.7823000     -0.7512000    
 C    5.870500      -1.391300     -0.6536000    
 C    6.085800     -0.2534000      -1.315000    
 C   -6.304500     -0.9227000     -0.6651000    
 C   -6.339600      0.6066000     -0.7032000    
 C   -4.987800      -1.268100     -2.3900000E-02
 C   -5.040600       1.043400     -8.1400000E-02
 H    2.161700       1.219900     -0.5672000    
 H    1.715100      -1.228800       1.215600    
 H    2.360700      -1.233300     -0.4312000    
 H    1.370900       2.587900       1.323800    
 H    1.075700       1.146400       2.292700    
 H  -0.8136000     -0.5283000       1.470900    
 H   0.3077000     -0.4375000      -1.371700    
 H  -6.0000001E-03  -1.870000     -0.4040000    
 H   -1.029400       1.938200       1.327400    
 H  -0.3480000       1.945000     -0.2907000    
 H    3.492900      0.3757000       2.061300    
 H    3.792900       1.891200       1.184600    
 H    6.351300      -2.341000     -0.8168000    
 H    6.777100     -9.1700003E-02  -2.124800    
 H   -6.348600      -1.346500      -1.672600    
 H   -7.126100      -1.323600     -6.4199999E-02
 H   -7.179200      0.9990000     -0.1222000    
 H   -6.401600      0.9772000      -1.730500    


%chk=000125175-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000125175

0 1
O -3.128030 -0.310262 0.755575
O -2.431493 0.059140 -1.477404
O 4.875388 -1.763887 1.649436
O 4.943645 1.785330 -1.426057
O -4.715927 -2.526668 -0.262497
O -4.643745 2.129731 0.460564
N 4.602555 0.174127 0.291572
N -4.456741 -0.224192 0.252507
C 2.133847 0.719479 0.337609
C 1.682666 -0.752548 0.175710
C 1.084796 1.520380 1.148986
C -0.761341 -0.058958 0.365041
C 0.279636 -0.858591 -0.462896
C -0.320287 1.433204 0.514499
C 3.514468 0.837002 1.027994
C -2.119226 -0.094696 -0.292511
C 5.196544 -1.063958 0.657431
C 5.229902 0.696140 -0.869207
C 6.269717 -1.333743 -0.369763
C 6.288905 -0.306229 -1.261972
C -6.528272 -0.835668 -0.674615
C -6.509218 0.698273 -0.428500
C -5.158891 -1.362814 -0.229788
C -5.125851 1.024427 0.143089
H 2.213081 1.178485 -0.669851
H 1.682511 -1.245193 1.169976
H 2.407068 -1.307751 -0.450310
H 1.386386 2.584163 1.216158
H 1.046459 1.129826 2.187648
H -0.853799 -0.498658 1.376055
H 0.297267 -0.459098 -1.495219
H -0.026533 -1.919229 -0.530741
H -1.056755 1.982885 1.128820
H -0.309390 1.903685 -0.488092
H 3.480536 0.367845 2.029467
H 3.781862 1.903787 1.144856
H 6.889588 -2.229628 -0.331824
H 6.928668 -0.156440 -2.131777
H -6.672251 -1.096386 -1.736667
H -7.313775 -1.355589 -0.100427
H -7.278447 1.028775 0.290160
H -6.652026 1.283104 -1.352639


