%chk=000048126.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000048126

0 1
 N   0.5051000      4.2599998E-02 -0.6105000    
 N  -0.7924000       3.153000      0.4839000    
 N   -5.028600      -1.683300      -1.905400    
 C   0.2561000       1.162600      -1.532400    
 C  -0.6759000     -0.5239000     -6.4800002E-02
 C    1.842200     -0.4264000     -0.4883000    
 C   0.3912000     -0.6303000       2.216300    
 C    1.536600      -1.557700       1.844600    
 C  -0.7717000     -0.8620000       1.295300    
 C    2.323400      -1.186700      0.6053000    
 C   0.9936000       2.418400      -1.069000    
 C   0.6336000       2.884000      0.3452000    
 C   -1.805200     -0.7574000     -0.8796000    
 C    2.766600     -0.1731000      -1.537300    
 C   -1.960500      -1.410400       1.809200    
 C    3.654200      -1.674300      0.5901000    
 C   -2.981500      -1.304000     -0.3632000    
 C   -3.059400      -1.630000      0.9836000    
 C    4.081400     -0.6452000      -1.523300    
 C    4.526000      -1.403600     -0.4575000    
 C   -1.199700       4.245300     -0.4021000    
 C   -1.123800       3.476000       1.872800    
 C   -4.111300      -1.513700      -1.213000    
 H   0.5140000      0.9004000      -2.565100    
 H  -0.8056000       1.433900      -1.585800    
 H   0.6922000      0.4190000       2.219400    
 H   8.8200003E-02 -0.8525000       3.247700    
 H    2.226800      -1.554500       2.699500    
 H    1.179700      -2.589800       1.729500    
 H   0.8183000       3.218000      -1.798400    
 H    2.079200       2.277400      -1.092700    
 H    1.220600       3.783500      0.5761000    
 H   0.9574000       2.129100       1.063600    
 H   -1.759600     -0.5366000      -1.945700    
 H    2.485200      0.3745000      -2.432400    
 H   -2.035600      -1.670100       2.862500    
 H    4.022300      -2.273100       1.421800    
 H   -3.966500      -2.053200       1.407600    
 H    4.745000     -0.4291000      -2.355300    
 H    5.541800      -1.785000     -0.4383000    
 H  -0.5977000       5.149300     -0.2545000    
 H   -2.248400       4.509800     -0.2201000    
 H   -1.157300       3.957500      -1.456600    
 H  -0.6071000       4.377100       2.222500    
 H  -0.8569000       2.645100       2.535400    
 H   -2.202800       3.629700       1.985900    


%chk=000048126-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000048126

0 1
N 0.518741 0.083442 -0.443374
N -0.836897 3.544912 0.310972
N -4.942327 -1.893394 -1.964747
C 0.249200 1.242134 -1.344055
C -0.636462 -0.611399 0.049381
C 1.833843 -0.504765 -0.439549
C 0.454998 -0.768450 2.327307
C 1.656679 -1.661435 1.935944
C -0.719678 -1.016479 1.413810
C 2.362202 -1.312902 0.623904
C 1.070141 2.497516 -0.969299
C 0.586509 3.129668 0.354584
C -1.736523 -0.845317 -0.812983
C 2.672982 -0.258007 -1.570398
C -1.891361 -1.664526 1.871375
C 3.672282 -1.841942 0.482114
C -2.912026 -1.478916 -0.334437
C -2.989396 -1.897904 1.021512
C 3.969509 -0.792029 -1.677978
C 4.483150 -1.603048 -0.643687
C -1.065474 4.756262 -0.502773
C -1.435392 3.666779 1.656160
C -4.020285 -1.705656 -1.225799
H 0.397241 0.981496 -2.412890
H -0.811101 1.515522 -1.210224
H 0.762293 0.294412 2.272716
H 0.171232 -0.982328 3.373602
H 2.412252 -1.615886 2.743897
H 1.307447 -2.713500 1.901529
H 0.983134 3.226266 -1.799091
H 2.144357 2.254580 -0.875879
H 1.259007 3.984866 0.621631
H 0.691855 2.375108 1.156949
H -1.680012 -0.552447 -1.865292
H 2.295538 0.345546 -2.398935
H -1.947885 -1.971476 2.922294
H 4.065360 -2.455633 1.303182
H -3.894940 -2.387876 1.391003
H 4.567786 -0.578997 -2.570936
H 5.489369 -2.029721 -0.706731
H -0.551337 5.662743 -0.091850
H -2.148218 4.969097 -0.552156
H -0.707871 4.602262 -1.535386
H -0.966210 4.467772 2.282460
H -1.338375 2.707310 2.195156
H -2.512136 3.896639 1.563467


