%chk=000035912.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000035912

0 1
 O   -1.027900       1.079800      0.6490000    
 O  -2.6300000E-02 -0.7879000       1.508300    
 N   -3.793300      -1.136500     -0.4631000    
 N    1.126000      0.7191000      0.1367000    
 C   -2.322500      0.4891000      0.6871000    
 C   -3.363000       1.588600      0.4981000    
 C   -2.437900     -0.5747000     -0.4085000    
 C   -4.756300      0.9881000      0.3639000    
 C   -4.792400     -9.0000004E-02 -0.7208000    
 C   -3.873400      -2.183100      -1.481800    
 C   3.5799999E-02  0.2301000      0.8298000    
 C    2.422200      0.1623000      4.7899999E-02
 C    3.404300      0.7927000     -0.7010000    
 C    2.682800      -1.021200      0.7224000    
 C    4.676800      0.2266000     -0.7774000    
 C    3.137400       2.068000      -1.432600    
 C    3.955400      -1.587300      0.6460000    
 C    4.952400     -0.9635000     -0.1040000    
 H   -2.475200      3.3100002E-02   1.674900    
 H   -3.122000       2.179700     -0.3950000    
 H   -3.327200       2.290400       1.339700    
 H   -2.147900     -0.1432000      -1.377000    
 H   -1.729000      -1.388200     -0.2177000    
 H   -5.062200      0.5544000       1.324400    
 H   -5.477900       1.777500      0.1253000    
 H   -5.796900     -0.5303000     -0.7305000    
 H   -4.629500      0.3718000      -1.703700    
 H   -3.659200      -1.800700      -2.486400    
 H   -4.871200      -2.635700      -1.490800    
 H   -3.166100      -2.990500      -1.261600    
 H   0.9657000       1.585700     -0.3685000    
 H    1.969800      -1.566400       1.322500    
 H    5.465500      0.6990000      -1.357000    
 H    4.024900       2.421700      -1.969000    
 H    2.346200       1.926900      -2.176400    
 H    2.846700       2.859300     -0.7336000    
 H    4.171500      -2.514000       1.169900    
 H    5.943100      -1.404400     -0.1633000    


%chk=000035912-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000035912

0 1
O -0.936875 0.770074 -0.105952
O 0.023674 -1.123250 0.930005
N -4.175926 -1.142796 -0.438893
N 1.306311 0.559780 -0.152144
C -2.300986 0.293377 0.275168
C -3.205717 1.530299 0.274275
C -2.780893 -0.756267 -0.746922
C -4.675520 1.100845 0.502102
C -5.094765 0.016721 -0.512482
C -4.631679 -2.291220 -1.244492
C 0.142409 -0.048707 0.290192
C 2.648474 0.113156 0.007855
C 3.683799 0.936089 -0.538070
C 2.965913 -1.097281 0.677238
C 5.023647 0.509837 -0.391151
C 3.359534 2.235536 -1.257439
C 4.314091 -1.492313 0.804996
C 5.350824 -0.694119 0.273337
H -2.243023 -0.175100 1.274316
H -3.109664 2.036162 -0.707127
H -2.874830 2.244390 1.049863
H -2.678948 -0.321834 -1.776725
H -2.138329 -1.651738 -0.683078
H -4.794774 0.693935 1.524146
H -5.342393 1.978519 0.409078
H -6.118758 -0.335903 -0.288744
H -5.110938 0.460118 -1.544911
H -4.674307 -2.074579 -2.342330
H -5.641557 -2.598075 -0.917626
H -3.949207 -3.145979 -1.091478
H 1.157174 1.440222 -0.648164
H 2.159915 -1.708714 1.088031
H 5.822473 1.135788 -0.806980
H 4.283192 2.728477 -1.602354
H 2.726441 2.072101 -2.153134
H 2.833450 2.957992 -0.600899
H 4.549588 -2.428324 1.323531
H 6.397382 -1.000917 0.373163


