%chk=000064477.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000064477

0 1
 O   -2.007400      -2.050000      6.1600000E-02
 N   -1.425300      0.2013000      0.4285000    
 C   0.8106000       1.302000      0.5428000    
 C   0.6218000      -1.205800      0.3497000    
 C  -6.1400000E-02  7.2099999E-02  0.8938000    
 C    1.571100      0.1388000      -1.567100    
 C    2.895200     -0.1248000      0.5609000    
 C   0.9148000       1.406400     -0.9922000    
 C    2.232000       1.145400       1.121800    
 C   0.7268000      -1.089800      -1.184500    
 C    2.044000      -1.352500      0.9295000    
 C    2.980800     -1.3400000E-02 -0.9712000    
 C   -2.101100       1.476900      0.4118000    
 C   -2.264400     -0.8556000      8.3999999E-02
 C   -3.315900       1.211400     -0.4546000    
 C   -3.621300     -0.2623000     -0.2148000    
 H   0.3850000       2.223200      0.9546000    
 H   9.4400004E-02  -2.117300      0.6356000    
 H  -0.1283000     -7.7999998E-03   1.986900    
 H    1.639300      0.2176000      -2.657800    
 H    3.901500     -0.2328000      0.9807000    
 H    1.516600       2.284700      -1.259000    
 H  -6.1200000E-02   1.552900      -1.465200    
 H    2.181900       1.087800       2.216000    
 H    2.837900       2.025800      0.8750000    
 H  -0.2552000      -1.021900      -1.662900    
 H    1.197100      -1.996100      -1.587300    
 H    2.515600      -2.265100      0.5446000    
 H    1.991000      -1.455300       2.020400    
 H    3.468900     -0.9043000      -1.385000    
 H    3.600800      0.8474000      -1.250100    
 H   -1.514200       2.293700     -7.7000000E-03
 H   -2.387000       1.723100       1.440100    
 H   -3.058400       1.361300      -1.510700    
 H   -4.159500       1.865400     -0.2174000    
 H   -4.070700     -0.7329000      -1.092500    
 H   -4.265700     -0.4007000      0.6589000    


%chk=000064477-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000064477

0 1
O -2.196057 -2.026725 0.801531
N -1.476173 0.176911 0.280609
C 0.808721 1.274539 0.478677
C 0.644243 -1.228525 0.109215
C -0.066316 0.012155 0.742527
C 1.811160 0.231506 -1.613304
C 2.896708 -0.171962 0.645740
C 1.084013 1.476216 -1.039272
C 2.165704 1.076219 1.211713
C 0.900972 -1.008480 -1.403801
C 1.999023 -1.421926 0.844403
C 3.160890 0.030232 -0.871249
C -2.128863 1.504278 0.128978
C -2.426059 -0.836336 0.435301
C -3.525017 1.152964 -0.448266
C -3.815247 -0.247716 0.138232
H 0.308568 2.172211 0.893732
H 0.005267 -2.112879 0.264865
H -0.101749 -0.159105 1.843187
H 2.000330 0.380530 -2.694948
H 3.858605 -0.310204 1.178088
H 1.705789 2.383958 -1.177000
H 0.141789 1.640049 -1.597762
H 1.998727 0.958036 2.301285
H 2.792573 1.979791 1.072747
H -0.059879 -0.870674 -1.937658
H 1.381783 -1.912457 -1.827564
H 2.506890 -2.321707 0.444171
H 1.824267 -1.602187 1.924371
H 3.690843 -0.851712 -1.283762
H 3.816904 0.910146 -1.031162
H -1.555095 2.166061 -0.538942
H -2.219481 2.010230 1.114809
H -3.468509 1.099772 -1.549894
H -4.283077 1.906952 -0.178833
H -4.376857 -0.915353 -0.535147
H -4.375291 -0.196009 1.091581


