%chk=000126444.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126444

0 1
 N    2.272500       2.433400     -7.6000001E-03
 N   -4.368700      0.3238000      -1.421800    
 C    3.712500     -7.9000004E-02  0.2754000    
 C    3.835000      0.7964000     -0.9955000    
 C    2.625500       1.710200      -1.233100    
 C    1.597000       3.712000     -0.1638000    
 C   0.1958000       3.660400      0.4410000    
 C  -0.6884000       2.591000     -0.2134000    
 C    3.143900      0.7074000       1.432700    
 C    2.514000       1.872600       1.231700    
 C   -2.080600       2.490700      0.4225000    
 C    2.968700      -1.377000      4.4000000E-03
 C   -2.933600       1.397100     -0.1500000    
 C   -2.993700      6.8700001E-02  0.3165000    
 C    3.649600      -2.467100     -0.5323000    
 C    1.609700      -1.470800      0.2944000    
 C   -3.909300     -0.5938000     -0.5040000    
 C   -3.776800       1.540000      -1.210500    
 C   -2.367200     -0.6512000       1.353100    
 C    2.967300      -3.658000     -0.7808000    
 C   0.9274000      -2.662000      4.6000000E-02
 C   -4.230800      -1.945700     -0.3391000    
 C    1.606400      -3.755400     -0.4916000    
 C   -2.679200      -2.004100       1.530000    
 C   -3.596900      -2.639500      0.6958000    
 H    4.734900     -0.3544000      0.5727000    
 H    4.018800      0.1856000      -1.887500    
 H    4.718300       1.440100     -0.8762000    
 H    2.869000       2.408900      -2.042100    
 H    1.766100       1.115200      -1.562400    
 H    1.525900       3.998800      -1.220000    
 H    2.181500       4.495600      0.3333000    
 H  -0.2770000       4.641600      0.3096000    
 H   0.2412000       3.486700       1.522100    
 H  -0.7884000       2.805800      -1.284900    
 H  -0.2102000       1.607800     -0.1373000    
 H    3.287000      0.3341000       2.442300    
 H    2.157900       2.454400       2.073700    
 H   -1.976800       2.337400       1.504200    
 H   -2.599300       3.451000      0.3032000    
 H    4.709400      -2.402600     -0.7632000    
 H    1.042000     -0.6379000      0.6968000    
 H   -4.017100       2.385700      -1.839600    
 H   -5.045100      0.1270000      -2.146600    
 H   -1.647100     -0.1725000       2.010600    
 H    3.495500      -4.509200      -1.200200    
 H  -0.1321000      -2.740300      0.2627000    
 H   -4.945000      -2.441300     -0.9881000    
 H    1.074600      -4.682100     -0.6866000    
 H   -2.197800      -2.564700       2.326900    
 H   -3.823600      -3.691300      0.8507000    


%chk=000126444-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000126444

0 1
N 2.401817 2.490656 0.065518
N -4.449547 0.186366 -1.525547
C 3.827937 -0.108335 0.276755
C 3.874734 0.802665 -0.995591
C 2.592621 1.653704 -1.135001
C 1.614321 3.732895 -0.003233
C 0.156647 3.624746 0.519284
C -0.697135 2.552734 -0.190174
C 3.374248 0.726923 1.462308
C 2.743792 1.934950 1.300064
C -2.183461 2.592314 0.265579
C 2.999387 -1.378584 0.018538
C -3.011881 1.445034 -0.259487
C -3.030287 0.085726 0.260563
C 3.616689 -2.505538 -0.587042
C 1.614812 -1.450071 0.314460
C -3.941045 -0.680532 -0.552106
C -3.890150 1.462844 -1.342755
C -2.374639 -0.555592 1.345459
C 2.872857 -3.665697 -0.896337
C 0.862095 -2.605592 0.000545
C -4.203748 -2.047692 -0.312277
C 1.488401 -3.717723 -0.607219
C -2.633946 -1.918003 1.592467
C -3.538071 -2.656758 0.771314
H 4.870935 -0.440873 0.463259
H 4.004433 0.186306 -1.904152
H 4.744130 1.482638 -0.914407
H 2.671990 2.314214 -2.019245
H 1.721903 0.980955 -1.298971
H 1.597617 4.057155 -1.061623
H 2.135428 4.529564 0.568698
H -0.321247 4.621381 0.406508
H 0.175191 3.410470 1.607602
H -0.652438 2.693271 -1.289251
H -0.277826 1.549124 0.013892
H 3.589228 0.370586 2.474096
H 2.485061 2.549579 2.171184
H -2.209420 2.588996 1.375106
H -2.626578 3.557178 -0.050784
H 4.690960 -2.471792 -0.813447
H 1.134185 -0.598296 0.810143
H -4.161104 2.290962 -1.995868
H -5.125289 -0.063352 -2.243596
H -1.680516 0.000987 1.986079
H 3.369720 -4.526992 -1.358624
H -0.209682 -2.631389 0.228595
H -4.898793 -2.619286 -0.937891
H 0.907101 -4.615289 -0.848112
H -2.139052 -2.422789 2.429707
H -3.719688 -3.715250 0.989118


