%chk=000043660.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043660

0 1
 N   -1.203000      0.3817000     -0.6407000    
 N   -4.423400      0.3896000      0.1464000    
 C   -3.299900      0.5037000     -0.7483000    
 C   -2.283000     -0.6329000     -0.5723000    
 C   -2.184500       1.398400     -0.1897000    
 C  -0.1902000      0.1377000      0.3940000    
 C   0.9245000       1.176100      0.3314000    
 C   0.2659000      -1.311000      0.4200000    
 C    2.064800       1.116700     -0.4972000    
 C   0.9898000      -1.882400     -0.6409000    
 C    2.448300     -1.1300000E-02  -1.432900    
 C    1.401700      -1.048400      -1.822500    
 C   0.7521000       2.315600       1.154700    
 C  -7.0699997E-02  -2.117800       1.522300    
 C   -5.361400       1.482400     -6.3000001E-02
 C    2.997500       2.179300     -0.4404000    
 C    1.360400      -3.235800     -0.5813000    
 C    1.680500       3.354500       1.184400    
 C   0.3034000      -3.460600       1.571400    
 C    2.809300       3.284700      0.3859000    
 C    1.018000      -4.020000      0.5186000    
 H   -3.547600      0.6911000      -1.801600    
 H   -2.400100      -1.173300      0.3759000    
 H   -2.269800      -1.364600      -1.387100    
 H   -2.085500       2.367800     -0.6899000    
 H   -2.243500       1.582700      0.8913000    
 H  -0.6564000      0.2752000       1.382100    
 H   -4.179300      0.3367000       1.134800    
 H    2.798900      0.4426000      -2.370200    
 H    3.312300     -0.5256000     -0.9893000    
 H    1.833100      -1.698700      -2.594900    
 H   0.5310000     -0.5834000      -2.295400    
 H  -0.1212000       2.401100       1.798700    
 H  -0.6343000      -1.707100       2.357100    
 H   -6.226500       1.351600      0.5946000    
 H   -5.733200       1.497400      -1.092900    
 H   -4.908300       2.452400      0.1663000    
 H    3.894900       2.144900      -1.056500    
 H    1.926200      -3.687600      -1.392400    
 H    1.519400       4.211100       1.831700    
 H   3.4400001E-02  -4.068200       2.430400    
 H    3.543200       4.084500      0.4027000    
 H    1.311200      -5.065100      0.5536000    


%chk=000043660-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000043660

0 1
N -1.235686 0.150351 -0.378595
N -4.618295 0.691263 -0.063149
C -3.326168 0.516218 -0.707157
C -2.474026 -0.703758 -0.239305
C -2.067233 1.408648 -0.326501
C -0.150140 -0.029485 0.629790
C 0.902695 1.082959 0.488971
C 0.405556 -1.453769 0.561868
C 1.915488 1.138219 -0.517342
C 1.005113 -1.953852 -0.629981
C 2.203873 0.077684 -1.588046
C 1.168337 -1.045941 -1.834893
C 0.827780 2.136460 1.441015
C 0.302864 -2.293436 1.695238
C -5.418321 1.844693 -0.513585
C 2.793758 2.257978 -0.522520
C 1.473921 -3.289274 -0.651008
C 1.708378 3.235975 1.423352
C 0.783442 -3.622631 1.668326
C 2.703973 3.297983 0.423258
C 1.367845 -4.125034 0.485057
H -3.472970 0.509013 -1.801428
H -2.703812 -0.967011 0.821831
H -2.485836 -1.620565 -0.850006
H -1.737455 2.209826 -1.008446
H -2.180701 1.819036 0.706047
H -0.589920 0.091318 1.654640
H -4.560368 0.617087 0.960114
H 2.368971 0.608687 -2.546937
H 3.175384 -0.395618 -1.332265
H 1.507540 -1.640068 -2.704621
H 0.194133 -0.585632 -2.080093
H 0.056241 2.082611 2.219386
H -0.157317 -1.901082 2.610987
H -6.396980 1.841409 -0.001460
H -5.611859 1.753329 -1.598514
H -4.940876 2.839149 -0.341058
H 3.572965 2.303284 -1.294803
H 1.930401 -3.676895 -1.570374
H 1.620448 4.027947 2.175180
H 0.697840 -4.257330 2.557361
H 3.401926 4.141826 0.382521
H 1.738089 -5.155873 0.446046


