%chk=000176822.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000176822

0 1
 N    3.887800     -0.1993000     -0.7929000    
 N    3.663900      -1.911500      0.6038000    
 N   -6.342300     -0.4467000      0.7844000    
 N   -6.159300       1.247800     -0.6394000    
 N    7.336800       2.726400      0.1951000    
 C  -0.7387000     -0.6970000     -0.4622000    
 C   -1.728000      0.1042000      0.3857000    
 C   0.6973000     -0.5047000      2.8600000E-02
 C   -3.167500     -0.1137000     -8.3600000E-02
 C    1.683600      -1.333100     -0.7997000    
 C   -4.153100      0.7148000      0.7452000    
 C    3.096500      -1.174700     -0.2973000    
 C    5.087000     -0.3157000     -0.1483000    
 C   -5.570700      0.5318000      0.2648000    
 C    6.223400      0.5784000     -0.4169000    
 C    4.924400      -1.378700      0.7088000    
 C    6.224600       1.829100      0.4890000    
 C   -7.551300     -0.3553000      0.1543000    
 C   -7.414200      0.6979000     -0.7193000    
 H  -0.8143000     -0.3848000      -1.510900    
 H   -1.000200      -1.761400     -0.4216000    
 H   -1.478800       1.170700      0.3283000    
 H   -1.637800     -0.1931000       1.437500    
 H   0.7679000     -0.7951000       1.084700    
 H   0.9664000      0.5578000     -2.5200000E-02
 H   -3.422600      -1.178400     -1.0500000E-02
 H   -3.255000      0.1599000      -1.142900    
 H    1.413000      -2.394800     -0.7486000    
 H    1.629400      -1.040800      -1.855600    
 H   -4.081100      0.4394000       1.804600    
 H   -3.896600       1.778900      0.6746000    
 H    3.647400      0.4855000      -1.498100    
 H    7.161400      2.6799999E-02 -0.2724000    
 H    6.209700      0.8904000      -1.469400    
 H    5.649700      -1.788900       1.396700    
 H    5.285600       2.381500      0.3669000    
 H    6.279900       1.528800       1.541800    
 H   -6.086000      -1.118700       1.496200    
 H   -8.369000      -1.025000      0.3781000    
 H   -8.155300       1.087400      -1.402100    
 H    8.216300       2.221700      0.3001000    
 H    7.294500       3.009900     -0.7832000    


%chk=000176822-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000176822

0 1
N 3.938358 -0.278191 -0.736235
N 3.898750 -2.224308 0.398750
N -6.351702 -0.479315 0.589272
N -6.322906 1.570036 -0.350588
N 7.107174 2.964589 0.225179
C -0.722356 -0.839900 -0.384014
C -1.701043 0.094584 0.361550
C 0.753360 -0.606543 0.007181
C -3.176100 -0.130726 -0.036966
C 1.724825 -1.557987 -0.745737
C -4.146713 0.809503 0.729963
C 3.165527 -1.381830 -0.360821
C 5.228648 -0.423419 -0.189519
C -5.585511 0.659526 0.324768
C 6.318482 0.594590 -0.368783
C 5.171607 -1.634997 0.506622
C 6.047695 1.955769 0.364011
C -7.633064 -0.279741 0.055514
C -7.593620 0.991371 -0.519498
H -0.841669 -0.698567 -1.478744
H -0.991120 -1.896508 -0.175600
H -1.427781 1.151152 0.159415
H -1.586399 -0.052433 1.455943
H 0.882282 -0.758076 1.096686
H 1.024665 0.450294 -0.196878
H -3.447959 -1.190874 0.149354
H -3.301006 0.037999 -1.124473
H 1.459591 -2.605205 -0.516365
H 1.593750 -1.422425 -1.839246
H -4.028767 0.645062 1.820838
H -3.872577 1.860582 0.531693
H 3.625130 0.501533 -1.313512
H 7.262327 0.170502 0.021490
H 6.492446 0.810190 -1.444433
H 5.967593 -2.117042 1.070633
H 5.101274 2.391842 -0.012120
H 5.890135 1.754121 1.439565
H -6.035756 -1.313158 1.082633
H -8.421585 -1.023256 0.132418
H -8.388723 1.522771 -1.036997
H 7.982063 2.738158 0.706107
H 7.265377 3.298024 -0.729958


