%chk=000176543.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000176543

0 1
 N  -0.6647000      0.9999000      5.0000002E-04
 N   7.2600000E-02  -1.115400      6.0000003E-04
 N   -2.942300       1.662100     -5.0000002E-04
 C   0.7213000       1.075000      5.0000002E-04
 C  -0.9900000     -0.3464000      6.9999998E-04
 C    1.144700     -0.2587000      3.9999999E-04
 C    2.532400     -0.5625000      9.9999997E-05
 C   -2.388600     -0.7354000      3.0000001E-04
 C   -1.679400       1.973000      1.9999999E-04
 C    3.469600      0.4965000     -9.9999997E-05
 C    1.646300       2.128200      5.0000002E-04
 C   -3.334200      0.3047000       0.000000    
 C    3.013000       1.819300      1.9999999E-04
 C    2.974500      -1.899400     -9.9999997E-05
 C   -2.799800      -2.070800      3.9999999E-04
 C   -1.259400       3.406900     -8.9999998E-04
 C    4.838700      0.1860000     -3.0000001E-04
 C   -4.695400     -1.5000000E-02 -3.0000001E-04
 C    4.339600      -2.182000     -3.9999999E-04
 C   -4.160900      -2.374000     -3.0000001E-04
 C    5.268500      -1.143100     -6.9999998E-04
 C   -5.106600      -1.349000     -5.0000002E-04
 H    1.347300       3.168600      6.0000003E-04
 H    3.725300       2.643300      9.9999997E-05
 H    2.266000      -2.724100      9.9999997E-05
 H   -2.075300      -2.880700      6.0000003E-04
 H   -2.144400       4.051600     -1.4000000E-03
 H  -0.6833000       3.634700      0.8994000    
 H  -0.6831000       3.633400     -0.9014000    
 H    5.585200      0.9777000     -3.9999999E-04
 H   -5.444200      0.7732000     -6.0000003E-04
 H    4.679900      -3.213500     -6.0000003E-04
 H   -4.485400      -3.410500     -3.9999999E-04
 H    6.331400      -1.367400     -1.0000000E-03
 H   -6.165900      -1.589100     -8.9999998E-04


%chk=000176543-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000176543

0 1
N -0.682405 1.010460 -0.000131
N 0.082045 -1.172549 -0.000053
N -2.979931 1.668834 -0.000275
C 0.734572 1.078536 -0.000154
C -1.013820 -0.389692 -0.000085
C 1.166994 -0.283431 -0.000108
C 2.563428 -0.615037 -0.000098
C -2.406812 -0.756354 -0.000074
C -1.699882 1.999050 -0.000189
C 3.504771 0.484778 -0.000142
C 1.664711 2.159271 -0.000195
C -3.366855 0.313107 -0.000204
C 3.024190 1.845031 -0.000192
C 3.039762 -1.960498 -0.000046
C -2.844470 -2.108514 -0.000006
C -1.304027 3.451175 -0.000378
C 4.905202 0.184045 -0.000137
C -4.753401 0.002915 -0.000249
C 4.415135 -2.220124 -0.000038
C -4.219158 -2.394342 -0.000052
C 5.353269 -1.141302 -0.000092
C -5.174620 -1.337589 -0.000171
H 1.348373 3.203731 -0.000243
H 3.762892 2.655088 -0.000227
H 2.305179 -2.771865 -0.000022
H -2.092337 -2.903590 0.000072
H -2.225094 4.050837 -0.000512
H -0.707174 3.709983 0.893615
H -0.707069 3.709766 -0.894368
H 5.625212 1.011254 -0.000173
H -5.466683 0.832470 -0.000362
H 4.778504 -3.253649 0.000001
H -4.559983 -3.435307 -0.000007
H 6.427493 -1.357140 -0.000091
H -6.244614 -1.572246 -0.000213


