%chk=000048312.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000048312

2 1
 N   -3.728300     -0.7432000     -1.4500000E-02
 N    3.699200     -0.7358000      3.1000001E-03
 C  -0.5637000       1.397800      0.4836000    
 C   0.5754000       1.392100     -0.4816000    
 C   1.7000000E-03   2.692200     -9.9999997E-05
 C   -1.918900      0.9794000     -2.0999999E-03
 C    1.914700      0.9711000     -1.8000000E-03
 C   -2.377400     -0.3553000      0.5690000    
 C    2.381300     -0.3688000     -0.5708000    
 C   -4.171600      -2.075000      0.5736000    
 C   -4.754200      0.3283000      0.3259000    
 C   -3.610300     -0.8705000      -1.526500    
 C    4.192900      -2.070200     -0.5734000    
 C    4.749800      0.3379000     -0.3131000    
 C    3.609200     -0.8800000       1.528700    
 H  -0.3965000       1.158500       1.526600    
 H   0.4044000       1.149300      -1.523200    
 H  -0.5733000       3.280200     -0.7057000    
 H   0.5773000       3.284800      0.7011000    
 H   -1.905700      0.9763000      -1.095100    
 H   -2.603600       1.776200      0.3070000    
 H    1.905600      0.9678000       1.091400    
 H    2.602400       1.765900     -0.3100000    
 H   -1.665700      -1.154100      0.3272000    
 H   -2.482400     -0.3067000       1.659600    
 H    1.665400      -1.164700     -0.3311000    
 H    2.479600     -0.3178000      -1.662100    
 H   -4.248200      -1.964600       1.659400    
 H   -5.144200      -2.339900      0.1484000    
 H   -3.424400      -2.831600      0.3163000    
 H   -4.559000       1.234600     -0.2527000    
 H   -5.743600     -5.3700000E-02  5.4000001E-02
 H   -4.713400      0.5251000       1.401200    
 H   -3.536300      0.1175000      -1.986600    
 H   -2.739500      -1.489300      -1.762100    
 H   -4.520400      -1.355000      -1.895700    
 H    3.457600      -2.840400     -0.3232000    
 H    4.281000      -1.959500      -1.658100    
 H    5.164900      -2.308000     -0.1313000    
 H    5.731600     -5.4800000E-02 -2.9500000E-02
 H    4.722100      0.5425000      -1.387300    
 H    4.549600       1.239200      0.2711000    
 H    2.751800      -1.516000       1.766800    
 H    4.533800      -1.349700       1.879700    
 H    3.520900      0.1038000       1.995200    


%chk=000048312-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000048312

2 1
N -3.914149 -0.743470 -0.196439
N 3.918896 -0.741068 0.197005
C -0.637449 1.394340 0.444402
C 0.639660 1.394463 -0.437632
C 0.001180 2.717935 0.003696
C -2.028678 1.070600 -0.115377
C 2.030904 1.070513 0.122124
C -2.437034 -0.391073 0.145230
C 2.441037 -0.389910 -0.142703
C -4.113264 -2.241639 0.055507
C -4.884458 0.033521 0.697315
C -4.224725 -0.444396 -1.663753
C 4.119317 -2.238812 -0.056261
C 4.887227 0.037561 -0.697438
C 4.230861 -0.442684 1.664164
H -0.498605 1.132651 1.502572
H 0.500799 1.133228 -1.495915
H -0.519585 3.316667 -0.749381
H 0.522072 3.316051 0.757188
H -2.042789 1.295969 -1.197857
H -2.741983 1.762229 0.371641
H 2.044017 1.292425 1.205328
H 2.743866 1.764437 -0.362146
H -1.817471 -1.086556 -0.448910
H -2.316568 -0.640936 1.214748
H 1.822868 -1.087866 0.449990
H 2.320221 -0.637087 -1.212806
H -3.877087 -2.465986 1.106888
H -5.161178 -2.506616 -0.151667
H -3.449145 -2.812823 -0.610995
H -4.799404 1.109824 0.493392
H -5.910309 -0.298907 0.476583
H -4.646870 -0.171849 1.752268
H -4.180286 0.639491 -1.839350
H -3.492570 -0.963367 -2.301280
H -5.237964 -0.808740 -1.892126
H 3.457649 -2.811231 0.611608
H 3.880750 -2.462850 -1.107168
H 5.168101 -2.502548 0.148086
H 5.913887 -0.292524 -0.476943
H 4.649718 -0.168839 -1.752211
H 4.799907 1.113776 -0.494061
H 3.499550 -0.962264 2.302167
H 5.244456 -0.806825 1.891310
H 4.186228 0.641082 1.840508


