%chk=000168919.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000168919

0 1
 N  -0.9370000       1.359200      6.5000001E-03
 N    1.567000      -1.418200      1.9000000E-03
 C   -2.770700     -0.7978000      2.5500000E-02
 C   -3.236100      0.5909000     -2.3700001E-02
 C   -3.773400      -1.917900      0.1337000    
 C   -4.704300      0.9002000     -0.1355000    
 C   -5.182000      -1.549100     -0.3242000    
 C   -5.619000     -0.2362000      0.3121000    
 C  -0.4546000      1.3300000E-02  3.5999999E-03
 C   -1.446300      -1.059800      2.0000000E-02
 C   -2.313500       1.573300     -1.4200000E-02
 C   0.8717000     -0.2332000      1.0000000E-03
 C    1.803500      0.8893000     -3.9999999E-04
 C  -9.9999998E-03   2.415800      6.0999999E-03
 C    3.049400      0.4162000     -2.4999999E-03
 C    1.326600       2.252500      2.9000000E-03
 C    2.813200      -1.046700     -6.0000003E-04
 C    4.367100      0.9641000     -4.0000002E-03
 C    4.014800      -1.910600     -1.0000000E-03
 C    5.410100      0.1183000     -4.1999999E-03
 C    5.223300      -1.323800     -2.7999999E-03
 H   -3.435200      -2.791500     -0.4374000    
 H   -3.822700      -2.227300       1.186400    
 H   -4.951400       1.800800      0.4403000    
 H   -4.923900       1.126400      -1.187500    
 H   -5.211500      -1.463700      -1.417700    
 H   -5.878600      -2.348000     -4.5600001E-02
 H   -5.600300     -0.3255000       1.405500    
 H   -6.652400     -9.1000004E-03  2.6300000E-02
 H   -1.093100      -2.086100      6.4800002E-02
 H   -2.603200       2.618600     -5.7399999E-02
 H  -0.4521000       3.406700      7.4000000E-03
 H    2.012600       3.089500      2.2000000E-03
 H    4.511000       2.037700     -4.8000002E-03
 H    3.891300      -2.986000      9.9999997E-05
 H    6.427800      0.4938000     -5.2000000E-03
 H    6.121300      -1.933600     -3.1000001E-03


%chk=000168919-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000168919

0 1
N -0.970641 1.383681 -0.025903
N 1.559448 -1.368539 0.013462
C -2.819673 -0.793422 0.004318
C -3.285997 0.574164 -0.036514
C -3.797730 -1.956902 0.086618
C -4.773602 0.906173 -0.112073
C -5.237793 -1.576384 -0.324716
C -5.666452 -0.261744 0.364874
C -0.491818 0.047670 -0.008739
C -1.440207 -1.010463 0.009207
C -2.355465 1.602176 -0.041419
C 0.922811 -0.153842 -0.001795
C 1.836440 0.992143 -0.008653
C -0.087406 2.478683 -0.031380
C 3.151958 0.410096 0.002605
C 1.295763 2.296556 -0.022804
C 2.924127 -1.031768 0.015190
C 4.473508 0.930269 0.003256
C 4.028155 -1.924710 0.028248
C 5.551996 0.028447 0.016285
C 5.327105 -1.386190 0.028730
H -3.424168 -2.799209 -0.525292
H -3.812957 -2.324151 1.134333
H -4.988042 1.823594 0.468330
H -5.032079 1.135350 -1.166787
H -5.297433 -1.447582 -1.424085
H -5.927747 -2.397955 -0.057773
H -5.584272 -0.379160 1.463857
H -6.724541 -0.031737 0.140670
H -1.011546 -2.017359 0.032748
H -2.657567 2.652890 -0.064170
H -0.560827 3.461850 -0.044870
H 1.931300 3.187798 -0.028317
H 4.656882 2.011620 -0.006392
H 3.855363 -3.005681 0.037673
H 6.580655 0.406667 0.017007
H 6.191852 -2.060528 0.038771


