%chk=000071509.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000071509

0 1
 O  -0.8933000      0.1093000       1.000900    
 O   0.1083000       1.769600     -0.2550000    
 N   -4.573900     -0.3456000     -0.6083000    
 C   -3.875800      0.8045000      -1.213600    
 C   -4.658800      3.7999999E-02  0.8137000    
 C   -4.519100       2.031500     -0.5581000    
 C   -5.039700       1.522200      0.7883000    
 C   -2.390200      0.6603000     -0.8291000    
 C   -3.253600     -0.1852000       1.406700    
 C   -2.175700      0.6416000      0.6917000    
 C   -5.883500     -0.5914000      -1.207000    
 C   0.1645000      0.7767000      0.4579000    
 C    1.444000      0.1070000      0.8670000    
 C    2.661800      0.8989000      0.4169000    
 C    1.428100      -1.374900      0.5477000    
 C    3.331200      0.7612000     -0.8164000    
 C    1.489800      -1.858000     -0.7699000    
 C    3.018300     -0.2403000      -1.908300    
 C    1.651100     -0.9128000      -1.927200    
 C    3.115500       1.892700       1.318300    
 C    1.309100      -2.300800       1.601400    
 C    4.447200       1.591500      -1.076800    
 C    1.433000      -3.241600      -1.008000    
 C    4.209700       2.707600       1.033300    
 C    1.255200      -3.672400       1.353700    
 C    4.880800       2.553500     -0.1675000    
 C    1.315700      -4.143000      4.7899999E-02
 H   -3.962000      0.8270000      -2.305900    
 H   -5.382200     -0.5643000       1.374800    
 H   -3.818100       2.863700     -0.4359000    
 H   -5.360000       2.395300      -1.160400    
 H   -6.128900       1.642600      0.8274000    
 H   -4.616700       2.083000       1.628100    
 H   -1.980100     -0.2560000      -1.275900    
 H   -1.857800       1.491200      -1.301400    
 H   -3.248800      6.4800002E-02   2.475100    
 H   -2.995600      -1.251900       1.353700    
 H   -2.218400       1.667200       1.081600    
 H   -6.566500      0.2623000      -1.148400    
 H   -6.365400      -1.444400     -0.7169000    
 H   -5.768300     -0.8605000      -2.262800    
 H    1.442600      0.1792000       1.966100    
 H    3.119100      0.2791000      -2.871500    
 H    3.800700      -1.011400      -1.882900    
 H    1.554700      -1.469100      -2.868700    
 H   0.8395000     -0.1788000      -1.943000    
 H    2.606000       2.041200       2.269200    
 H    1.251300      -1.957200       2.631800    
 H    4.992700       1.487200      -2.013600    
 H    1.486400      -3.627500      -2.023300    
 H    4.532700       3.456800       1.749500    
 H    1.162900      -4.370200       2.180600    
 H    5.737800       3.177700     -0.4008000    
 H    1.274000      -5.209900     -0.1496000    


%chk=000071509-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000071509

0 1
O -0.949956 0.245439 0.751183
O 0.099154 1.001350 -1.190618
N -5.071514 -0.106295 0.473532
C -4.418751 -0.041568 -0.875788
C -4.623901 1.190668 1.077940
C -4.673232 1.427845 -1.383160
C -4.809003 2.260840 -0.062217
C -2.909604 -0.337023 -0.674903
C -3.136745 1.024342 1.485385
C -2.279174 0.731993 0.242613
C -6.543705 -0.264874 0.420225
C 0.154323 0.416592 -0.084606
C 1.395915 -0.228494 0.577267
C 2.586763 0.747397 0.574645
C 1.568285 -1.652061 0.025788
C 3.639735 0.818300 -0.384188
C 2.066872 -1.920774 -1.280740
C 3.830924 -0.113763 -1.582044
C 2.573528 -0.800044 -2.170271
C 2.581616 1.674837 1.654931
C 1.151114 -2.729907 0.845871
C 4.637203 1.819429 -0.211460
C 2.131327 -3.265798 -1.722221
C 3.576004 2.658499 1.809867
C 1.221200 -4.066221 0.395411
C 4.620766 2.730698 0.861529
C 1.712724 -4.336168 -0.900642
H -4.857770 -0.801826 -1.544723
H -5.226856 1.418570 1.974149
H -3.849887 1.785720 -2.026376
H -5.600882 1.477321 -1.980348
H -5.803999 2.734931 0.007000
H -4.056819 3.066561 0.008033
H -2.811124 -1.327667 -0.195960
H -2.382416 -0.357977 -1.645858
H -2.766077 1.932964 1.995685
H -3.060573 0.175569 2.187931
H -2.082514 1.653684 -0.336047
H -7.083125 0.536349 -0.140401
H -6.941894 -0.286788 1.450308
H -6.785034 -1.232856 -0.053948
H 1.101580 -0.350332 1.633711
H 4.312152 0.475662 -2.386482
H 4.559668 -0.903551 -1.303622
H 2.838840 -1.219201 -3.158709
H 1.788881 -0.039311 -2.333934
H 1.770281 1.616544 2.391944
H 0.759959 -2.517128 1.848058
H 5.447097 1.877782 -0.950058
H 2.517410 -3.472009 -2.728117
H 3.538490 3.353565 2.655762
H 0.894701 -4.883631 1.047615
H 5.408769 3.486220 0.955609
H 1.770568 -5.367208 -1.267455


