%chk=000113717.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000113717

0 1
 N    2.184600      9.6299998E-02 -0.3440000    
 N  -0.3987000       1.342000     -0.3559000    
 C    1.958600       1.356100      0.3908000    
 C   0.8085000       2.164500     -0.2303000    
 C    3.224800       2.215000      0.3789000    
 C   0.9907000     -0.6709000     -0.7232000    
 C  -0.1230000      0.2271000      -1.264400    
 C    4.356300       1.470000       1.062400    
 C    3.405400     -0.5716000     -0.1333000    
 C    4.488100      7.0799999E-02  0.5182000    
 C   -1.516000       2.144000     -0.8546000    
 C   -2.784000       1.295500     -0.9344000    
 C    3.636600      -1.890400     -0.5774000    
 C    5.709400     -0.5965000      0.7302000    
 C   -3.154800      0.7281000      0.4381000    
 C    4.858000      -2.543400     -0.3739000    
 C    5.894400      -1.897700      0.2820000    
 C   -4.425200     -8.1200004E-02  0.3825000    
 C   -5.643500      0.5469000      0.5949000    
 C   -4.356100      -1.441400      0.1201000    
 C   -6.819300     -0.2020000      0.5437000    
 C   -5.531700      -2.190400      6.8899997E-02
 C   -6.763200      -1.570700      0.2808000    
 H    1.693400       1.109000       1.428900    
 H   0.6029000       3.025900      0.4183000    
 H    1.106700       2.563100      -1.210300    
 H    3.053600       3.168800      0.8916000    
 H    3.511100       2.450200     -0.6552000    
 H   0.6305000      -1.231900      0.1485000    
 H    1.208000      -1.386700      -1.522100    
 H   0.1547000      0.5958000      -2.261300    
 H  -0.9846000     -0.4339000      -1.391600    
 H    4.168100       1.408600       2.141200    
 H    5.289300       2.026600      0.9150000    
 H   -1.298100       2.567200      -1.843700    
 H   -1.700100       2.987000     -0.1766000    
 H   -2.730400      0.5132000      -1.698500    
 H   -3.597500       1.952700      -1.272100    
 H    2.872100      -2.461400      -1.095800    
 H    6.523300     -9.5500000E-02   1.249100    
 H   -2.355500      9.0999998E-02  0.8364000    
 H   -3.273100       1.543000       1.164400    
 H    4.991400      -3.561100     -0.7300000    
 H    6.840500      -2.404100      0.4453000    
 H   -5.697800       1.612600      0.7985000    
 H   -3.401900      -1.932700     -4.8599999E-02
 H   -7.778200      0.2805000      0.7081000    
 H   -5.488300      -3.256000     -0.1366000    
 H   -7.678600      -2.153800      0.2406000    


%chk=000113717-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000113717

0 1
N 2.288184 0.040499 -0.344906
N -0.374571 1.191082 -0.531402
C 1.924912 1.237645 0.458760
C 0.811959 2.032721 -0.256198
C 3.153793 2.133437 0.693649
C 1.113808 -0.784780 -0.699126
C 0.023583 0.051530 -1.388524
C 4.269461 1.335917 1.391615
C 3.568345 -0.556664 -0.194061
C 4.576937 0.058394 0.623016
C -1.506038 1.977776 -1.087252
C -2.857289 1.233574 -1.032105
C 3.908744 -1.765272 -0.875096
C 5.857122 -0.529016 0.712849
C -3.290966 0.881066 0.417149
C 5.190476 -2.338918 -0.756708
C 6.183380 -1.726657 0.039691
C -4.575303 0.067995 0.455809
C -5.843958 0.704722 0.471171
C -4.537160 -1.350925 0.435063
C -7.038472 -0.050617 0.463349
C -5.728076 -2.112073 0.426552
C -6.985054 -1.463823 0.439536
H 1.519034 0.910286 1.446478
H 0.505979 2.871597 0.396888
H 1.239975 2.465166 -1.198348
H 2.851075 3.002414 1.307928
H 3.516032 2.517056 -0.279842
H 0.681000 -1.253495 0.214842
H 1.409367 -1.592962 -1.384246
H 0.404188 0.404803 -2.381731
H -0.852536 -0.595840 -1.570912
H 3.948166 1.090445 2.425370
H 5.185345 1.948607 1.486039
H -1.301564 2.292247 -2.143599
H -1.586658 2.905861 -0.487063
H -2.817972 0.306980 -1.637156
H -3.627804 1.872978 -1.506938
H 3.180741 -2.266227 -1.519101
H 6.612918 -0.032621 1.335784
H -2.459817 0.330345 0.894808
H -3.418349 1.824743 0.984382
H 5.411023 -3.266797 -1.297386
H 7.181682 -2.166691 0.131160
H -5.893969 1.801008 0.495579
H -3.565120 -1.860800 0.434680
H -8.008279 0.460224 0.480412
H -5.676927 -3.207075 0.415977
H -7.909948 -2.051662 0.436766


