%chk=000153041.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000153041

1 1
 N  -0.4395000     -0.8997000      3.9999999E-04
 N   -5.183800      -1.602800      3.0000001E-04
 N    2.916600       4.139200     -9.9999997E-05
 C  -0.2836000      -2.372700      1.7000000E-03
 C   0.6713000     -0.1592000      6.9999998E-04
 C   -1.677700     -0.3784000     -9.9999997E-05
 C   0.6030000       1.228200      3.9999999E-04
 C   -1.839900       1.027500     -5.0000002E-04
 C  -0.6660000       1.851700     -9.9999997E-05
 C    1.915600     -0.9071000      1.9999999E-04
 C  -0.8812000      -2.963100      -1.269700    
 C  -0.8814000      -2.960800       1.273900    
 C   -2.782400      -1.243500     -3.0000001E-04
 C    1.781700       1.992100      6.0000003E-04
 C   -3.171400       1.509800     -1.0000000E-03
 C  -0.6825000       3.268100     -1.9999999E-04
 C   -4.075200     -0.7316000     -7.9999998E-04
 C    1.727300       3.382600      3.9999999E-04
 C   -4.270000      0.6438000     -1.2000001E-03
 C   0.4952000       4.020800      1.9999999E-04
 C    2.510200      -1.263800       1.207700    
 C    2.507200      -1.265600      -1.208200    
 C    3.704500      -1.984100       1.206700    
 C    3.701600      -1.986100      -1.209200    
 C    4.300300      -2.345400     -1.7000000E-03
 H   0.7399000      -2.733900      2.0999999E-03
 H   -1.627000      -3.745200      -1.094600    
 H  -8.0300003E-02  -3.461300      -1.833200    
 H   -1.283800      -2.220900      -1.966900    
 H   -1.626100      -3.744100       1.099800    
 H   -1.285500      -2.217500       1.969100    
 H  -8.0300003E-02  -3.456800       1.839100    
 H   -2.752600      -2.319000      5.0000002E-04
 H    2.764300       1.525200      7.9999998E-04
 H   -3.381400       2.576400     -1.2000001E-03
 H   -1.620500       3.817600     -5.0000002E-04
 H   -5.273500       1.062300     -1.4000000E-03
 H   0.4308000       5.106000       0.000000    
 H    2.057100     -0.9907000       2.157600    
 H    2.051700     -0.9940000      -2.157500    
 H    4.170500      -2.264400       2.146900    
 H    4.165100      -2.267800      -2.150100    
 H   -6.122500      -1.226400     -1.7000000E-03
 H   -5.043400      -2.604200     -1.1000000E-03
 H    3.814000       3.672900      6.9999998E-04
 H    2.873800       5.149700      3.9999999E-04
 H    5.230100      -2.906600     -2.4000001E-03


%chk=000153041-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000153041

1 1
N -0.518292 -1.031857 0.007395
N -5.426266 -1.389767 -0.054507
N 2.889407 4.112142 0.007975
C -0.354774 -2.556423 0.037342
C 0.628404 -0.269718 0.003293
C -1.814209 -0.432871 -0.001721
C 0.574596 1.166425 0.009225
C -1.907704 1.008498 0.014569
C -0.714888 1.818521 0.024865
C 1.971331 -0.941415 -0.011091
C -0.798572 -3.225561 -1.282962
C -0.895039 -3.185852 1.342165
C -2.992975 -1.221626 -0.027368
C 1.780214 1.933951 0.001696
C -3.220212 1.583027 0.014435
C -0.728388 3.249496 0.041958
C -4.274690 -0.624344 -0.029144
C 1.739633 3.342482 0.015438
C -4.370763 0.808809 -0.004954
C 0.449978 3.987533 0.038253
C 2.662523 -1.183277 1.205345
C 2.592844 -1.263310 -1.246641
C 3.947585 -1.769786 1.184870
C 3.879096 -1.847353 -1.261212
C 4.556836 -2.105592 -0.046811
H 0.735932 -2.689467 0.080912
H -1.875989 -3.161937 -1.495220
H -0.528294 -4.295271 -1.232475
H -0.258913 -2.786255 -2.140294
H -1.991073 -3.212924 1.426655
H -0.500759 -2.651094 2.224239
H -0.530147 -4.226866 1.394059
H -2.940493 -2.307174 -0.049402
H 2.743859 1.417909 -0.015111
H -3.329161 2.669889 0.028007
H -1.676300 3.792677 0.057564
H -5.356479 1.286730 -0.004464
H 0.402579 5.082872 0.051011
H 2.198448 -0.912924 2.160600
H 2.076567 -1.051601 -2.189912
H 4.472287 -1.959155 2.126943
H 4.351243 -2.095258 -2.217392
H -6.343834 -0.950928 -0.058796
H -5.391350 -2.406138 -0.070417
H 3.811028 3.682590 -0.009331
H 2.841935 5.127821 0.017293
H 5.553541 -2.558428 -0.060384


