%chk=000076928.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076928

0 1
 N   9.8099999E-02   1.746500      3.0000001E-04
 N   -2.679700       1.883600     -1.9999999E-04
 C   1.9900000E-02 -0.6621000       0.000000    
 C    1.420700     -0.7014000      9.9999997E-05
 C  -0.6090000      0.6006000       0.000000    
 C    2.152100      0.4777000      3.9999999E-04
 C   -2.000600      0.6391000       0.000000    
 C  -0.7493000      -1.838100     -9.9999997E-05
 C    2.163600      -2.003300      5.0000002E-04
 C    1.448300       1.664900      3.9999999E-04
 C   -2.765600     -0.5300000     -1.9999999E-04
 C    3.641100      0.4928000     -1.2000001E-03
 C   -2.139600      -1.770300     -1.9999999E-04
 H  -0.2951000      -2.825300     -9.9999997E-05
 H    1.904700      -2.583200     -0.8926000    
 H    3.252000      -1.917900      1.1000000E-03
 H    1.904000      -2.582900      0.8936000    
 H    1.953000       2.626200      1.9999999E-04
 H    4.029600       1.517900     -1.6000000E-03
 H    4.038500      6.5000001E-03  0.8958000    
 H    4.036600      6.3999998E-03 -0.8989000    
 H   -3.851700     -0.4831000     -3.0000001E-04
 H   -2.730900      -2.680900     -3.0000001E-04
 H   -3.690600       1.910400      6.0000003E-04
 H   -2.148100       2.744100      6.9999998E-04


%chk=000076928-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000076928

0 1
N 0.056003 1.759331 -0.000100
N -2.635257 1.921156 -0.000055
C 0.018333 -0.725277 -0.000005
C 1.465512 -0.744516 -0.000138
C -0.636461 0.563064 -0.000017
C 2.160988 0.484018 -0.000290
C -2.086472 0.654143 0.000058
C -0.788833 -1.909350 0.000153
C 2.189604 -2.076802 -0.000145
C 1.399309 1.700042 -0.000212
C -2.843120 -0.537308 0.000206
C 3.677244 0.580659 -0.000483
C -2.185814 -1.798560 0.000264
H -0.318644 -2.896959 0.000169
H 1.914797 -2.677846 -0.888116
H 3.283203 -1.953584 -0.000170
H 1.914824 -2.677826 0.887847
H 1.928795 2.661936 -0.000296
H 3.997601 1.637191 -0.000710
H 4.122422 0.097936 0.889945
H 4.122209 0.097616 -0.890846
H -3.938456 -0.488834 0.000263
H -2.797369 -2.708910 0.000376
H -3.638667 2.072834 0.000307
H -1.979751 2.704047 -0.000005


