%chk=000041011.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041011

0 1
 N    1.231500       1.573600      0.2505000    
 N  -0.5892000      4.9899999E-02 -2.1800000E-02
 N  -0.8840000       2.387300      0.4093000    
 C    2.362800      0.7385000      0.1299000    
 C    4.597800     -0.9125000     -0.1096000    
 C    3.558100       1.252500     -0.3719000    
 C    2.284100     -0.6002000      0.5120000    
 C    4.675900      0.4266000     -0.4918000    
 C    3.401800      -1.426000      0.3922000    
 C   -4.730500     -0.5664000     -0.1152000    
 C   -1.972000     -0.1553000     -5.2900001E-02
 C   -4.045700     -0.2521000      -1.288900    
 C   -4.036200     -0.6752000       1.089800    
 C   -2.666400     -4.6599999E-02  -1.257800    
 C   -2.656900     -0.4695000       1.120900    
 C  -0.1186000       1.255300      0.1902000    
 C    5.793000      -1.795200     -0.2376000    
 C   -6.205400     -0.7847000     -0.1474000    
 H    3.631700       2.293900     -0.6745000    
 H    1.385700      -1.029400      0.9431000    
 H    5.601400      0.8378000     -0.8862000    
 H    3.330800      -2.466000      0.6994000    
 H    1.464100       2.563400      0.2495000    
 H   -4.575200     -0.1661000      -2.234100    
 H   -4.558500     -0.9212000       2.010600    
 H   -2.141200      0.1969000      -2.177700    
 H   -2.124300     -0.5574000       2.064300    
 H    5.791900      -2.575900      0.5307000    
 H    5.803700      -2.272400      -1.222600    
 H    6.720200      -1.225500     -0.1135000    
 H   -6.670200     -0.4820000      0.7971000    
 H   -6.675700     -0.1923000     -0.9397000    
 H   -6.424700      -1.842400     -0.3235000    
 H   -1.897500       2.362100      0.4118000    
 H  -0.4508000       3.288700      0.5787000    


%chk=000041011-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000041011

0 1
N 1.297867 1.710338 0.098378
N -0.614717 0.354591 -0.297765
N -0.813468 2.658515 0.398174
C 2.359874 0.769974 0.007514
C 4.620131 -0.990314 -0.130669
C 3.685136 1.277606 0.097798
C 2.168859 -0.627397 -0.156677
C 4.791801 0.408703 0.028935
C 3.291748 -1.479228 -0.216140
C -4.779500 -0.661109 0.009688
C -2.001371 0.079660 -0.173662
C -4.060732 -0.788021 -1.209493
C -4.076274 -0.166763 1.136821
C -2.700664 -0.433294 -1.303042
C -2.714828 0.201083 1.055789
C -0.086490 1.500654 0.069971
C 5.813955 -1.924349 -0.234985
C -6.240337 -1.069785 0.102625
H 3.849840 2.355792 0.230755
H 1.150957 -1.011021 -0.246614
H 5.804100 0.824666 0.103548
H 3.125653 -2.556978 -0.339070
H 1.589911 2.689024 0.107577
H -4.574969 -1.176396 -2.098076
H -4.599124 -0.075593 2.097508
H -2.151265 -0.548642 -2.243224
H -2.187014 0.547564 1.952428
H 5.600553 -2.906179 0.224448
H 6.087695 -2.111510 -1.292090
H 6.704119 -1.502110 0.264400
H -6.680877 -0.775934 1.071403
H -6.844339 -0.603427 -0.698191
H -6.360320 -2.165960 0.001767
H -1.827337 2.615824 0.311954
H -0.417073 3.392215 0.981518


