%chk=000066977.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000066977

0 1
 N   -5.947700      0.5640000      2.9100001E-02
 N    5.929500      0.5694000     -0.1533000    
 N   -8.222100     -0.1682000     -0.2176000    
 N   -7.480500       1.705600      -1.282400    
 N    8.171500     -0.1392000      0.3384000    
 N    7.426900       1.911000      0.9999000    
 C  -0.6801000     -0.5736000     -0.2582000    
 C   0.7419000     -0.5182000      0.3048000    
 C   -1.721700     -0.4396000      0.8544000    
 C    1.785600     -0.6195000     -0.8090000    
 C   -3.164400     -0.5788000      0.3592000    
 C    3.207000     -0.5974000     -0.2434000    
 C   -4.251800     -0.5036000       1.437800    
 C    4.249400     -0.7395000      -1.356400    
 C   -5.682100     -0.5718000      0.9131000    
 C    5.677900     -0.7069000     -0.8247000    
 C   -7.150500      0.6666000     -0.4445000    
 C    7.111100      0.7395000      0.3529000    
 H  -0.8229000      0.2302000     -0.9903000    
 H  -0.8274000      -1.523100     -0.7869000    
 H   0.8839000      0.4198000      0.8553000    
 H   0.8850000      -1.337800       1.019500    
 H   -1.537300      -1.206700       1.616900    
 H   -1.604200      0.5324000       1.349100    
 H    1.630100      -1.547600      -1.372500    
 H    1.655800      0.2118000      -1.512600    
 H   -3.342900      0.2043000     -0.3880000    
 H   -3.266600      -1.535900     -0.1682000    
 H    3.358700      0.3411000      0.3026000    
 H    3.330400      -1.414700      0.4775000    
 H   -4.098500      -1.322300       2.151400    
 H   -4.123200      0.4309000       1.998400    
 H    4.089600      -1.682900      -1.892000    
 H    4.114900      7.1099997E-02  -2.083400    
 H   -6.363800     -0.5553000       1.772000    
 H   -5.822200      -1.516400      0.3740000    
 H    5.821000      -1.542600     -0.1290000    
 H    6.365700     -0.8345000      -1.669300    
 H   -8.153700     -0.9879000      0.3747000    
 H   -9.124300      1.2200000E-02 -0.6446000    
 H   -6.794700       2.405900      -1.543300    
 H   -8.415500       1.804200      -1.662300    
 H    8.112100      -1.051700     -9.8999999E-02
 H    9.057000      0.1035000      0.7696000    
 H    6.746600       2.657500       1.093000    
 H    8.344700       2.063400       1.403400    


%chk=000066977-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000066977

0 1
N -5.932395 0.539652 -0.019211
N 6.004338 0.659987 -0.388229
N -8.316765 0.065329 -0.127118
N -7.424001 2.016043 -1.082641
N 8.103224 0.024149 0.669672
N 7.156408 2.142336 1.029414
C -0.674684 -0.749775 -0.281404
C 0.776686 -0.637109 0.237292
C -1.738532 -0.584728 0.827406
C 1.841586 -0.793840 -0.871660
C -3.188053 -0.705576 0.308169
C 3.290690 -0.695575 -0.345936
C -4.247158 -0.554615 1.420161
C 4.353029 -0.839793 -1.455174
C -5.692960 -0.607477 0.882528
C 5.796755 -0.701076 -0.926268
C -7.159975 0.825416 -0.380896
C 7.040135 0.899930 0.379462
H -0.844580 0.016204 -1.066847
H -0.811426 -1.734868 -0.775670
H 0.912827 0.344811 0.737100
H 0.946215 -1.407804 1.018895
H -1.562594 -1.346001 1.617593
H -1.606861 0.403825 1.315716
H 1.697074 -1.770467 -1.381334
H 1.680563 -0.014084 -1.645706
H -3.384958 0.065268 -0.461553
H -3.318973 -1.690790 -0.189497
H 3.446234 0.278468 0.157305
H 3.454829 -1.480065 0.424263
H -4.112450 -1.355578 2.177411
H -4.104454 0.414827 1.937150
H 4.243152 -1.824351 -1.956348
H 4.190961 -0.058879 -2.224129
H -6.402576 -0.616040 1.746306
H -5.828798 -1.575808 0.342901
H 5.973999 -1.494926 -0.157011
H 6.501362 -0.901931 -1.766667
H -8.220142 -0.849616 0.303601
H -9.228479 0.516313 -0.093426
H -6.605122 2.605044 -1.229168
H -8.132363 2.009724 -1.816128
H 8.150843 -0.868767 0.187343
H 8.625379 0.126216 1.537453
H 6.370205 2.771768 0.872691
H 8.080003 2.562930 1.128290


