%chk=000134045.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000134045

0 1
 O   0.7478000       1.901600       1.998000    
 O    5.470400      -1.251100     -0.5892000    
 O    2.978100      -3.105800      0.8302000    
 N   -1.025900       3.008200      1.9600000E-02
 N    2.519000      -2.870500      -1.404100    
 C   -2.120700       2.892200     -0.9440000    
 C   -2.639400       1.443800      -1.014500    
 C   5.9799999E-02   2.103600     -0.3237000    
 C   -3.153900      0.8739000      0.3160000    
 C    1.208300       2.221900      0.6858000    
 C   -3.250400       3.845100     -0.5520000    
 C    2.346500       1.286200      0.3425000    
 C   -3.593900     -0.5661000      0.2339000    
 C    2.100500     -7.2800003E-02  0.2491000    
 C    3.610000       1.809900      0.1303000    
 C   -4.912000     -0.8586000     -8.2400002E-02
 C   -2.673300      -1.574300      0.4763000    
 C    3.150700     -0.9348000     -6.6399999E-02
 C    4.660300      0.9477000     -0.1852000    
 C    4.430600     -0.4246000     -0.2835000    
 C   -5.319200      -2.190600     -0.1580000    
 C   -3.080200      -2.906400      0.4007000    
 C   -4.403300      -3.214500      8.3600000E-02
 C    2.890000      -2.364300     -0.1628000    
 H   -1.767100       3.184300      -1.941400    
 H   -1.899700      0.7712000      -1.464600    
 H   -3.473400       1.423400      -1.731300    
 H  -0.6850000       3.968900      3.9400000E-02
 H  -0.2899000       1.070300     -0.2905000    
 H   0.4328000       2.310000      -1.334800    
 H   -3.997900       1.471300      0.6819000    
 H   -2.384700      0.9557000       1.094000    
 H    1.569100       3.257800      0.7144000    
 H   -3.591900       3.687300      0.4764000    
 H   -2.915100       4.886200     -0.6258000    
 H   -4.110900       3.728900      -1.219500    
 H    1.111400     -0.4821000      0.4349000    
 H    3.801600       2.876300      0.2042000    
 H   -5.632200     -6.8499997E-02 -0.2744000    
 H   -1.640100      -1.344400      0.7214000    
 H  -1.4000000E-02   2.476000       2.186500    
 H    5.655100       1.351600     -0.3525000    
 H   -6.349100      -2.430700     -0.4056000    
 H   -2.366800      -3.703600      0.5878000    
 H   -4.720000      -4.251700      2.4300000E-02
 H    5.170200      -2.173600     -0.6273000    
 H    2.319200      -3.857600      -1.526600    
 H    2.434400      -2.278500      -2.224300    


%chk=000134045-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000134045

0 1
O -0.093212 1.490333 1.660503
O 4.832970 -1.614546 -1.128002
O 2.979866 -3.301680 -1.387162
N -0.993383 3.348519 0.099857
N 0.809209 -2.897561 -0.732545
C -2.017244 3.069714 -0.962571
C -2.333895 1.549729 -1.034221
C 0.409657 2.968946 -0.220946
C -3.192468 0.996512 0.139347
C 1.023463 2.137524 0.981504
C -3.264663 3.936304 -0.700924
C 2.028893 1.112733 0.484055
C -3.126448 -0.521990 0.234474
C 1.608720 -0.171264 0.092895
C 3.403439 1.451539 0.342378
C -4.000294 -1.340416 -0.526719
C -2.166717 -1.150512 1.074840
C 2.514471 -1.120680 -0.448886
C 4.325155 0.538829 -0.194041
C 3.898323 -0.752062 -0.602944
C -3.923725 -2.750552 -0.454856
C -2.095239 -2.561522 1.156344
C -2.971727 -3.367390 0.389725
C 2.109953 -2.485401 -0.873708
H -1.602177 3.360037 -1.956188
H -1.377947 0.992650 -1.068976
H -2.846890 1.342870 -1.994297
H -1.072548 4.311174 0.451280
H 0.402979 2.328501 -1.119884
H 1.048173 3.845970 -0.442663
H -4.242139 1.320747 0.006384
H -2.838130 1.440980 1.087405
H 1.529849 2.840544 1.679426
H -3.674303 3.753779 0.308497
H -3.024439 5.013123 -0.785493
H -4.054524 3.709743 -1.438412
H 0.551960 -0.415360 0.246731
H 3.753116 2.440733 0.664814
H -4.752971 -0.870162 -1.172491
H -1.488158 -0.526721 1.671006
H -0.868400 2.104650 1.398387
H 5.384346 0.787961 -0.304947
H -4.611567 -3.366139 -1.045829
H -1.374606 -3.030489 1.837243
H -2.924392 -4.459971 0.462148
H 4.323856 -2.491103 -1.360221
H 0.579866 -3.839906 -1.046975
H 0.069742 -2.330518 -0.318541


