%chk=000155602.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000155602

0 1
 N  -0.3680000       1.753400      6.0000003E-04
 C  -0.6192000     -0.4623000      3.9999999E-04
 C   -1.308600      0.7506000      1.9999999E-04
 C   0.7794000     -0.1587000      5.0000002E-04
 C   0.9038000       1.230900      3.9999999E-04
 C   -1.363200      -1.660800      1.9999999E-04
 C   -2.706100      0.8270000     -1.9999999E-04
 C    1.953200     -0.9410000      3.9999999E-04
 C    2.143800       1.879800      1.9999999E-04
 C   -2.761400      -1.600600     -3.0000001E-04
 C   -3.420900     -0.3739000     -5.0000002E-04
 C    3.200600     -0.3064000     -9.9999997E-05
 C    3.292100       1.083400     -5.0000002E-04
 C  -0.7262000      -3.015200      3.0000001E-04
 C   -3.445100       2.123700     -6.0000003E-04
 C    4.445800      -1.130000     -8.9999998E-04
 H  -0.5754000       2.742200      6.0000003E-04
 H    1.898900      -2.025300      2.4999999E-03
 H    2.215600       2.962300      6.0000003E-04
 H   -3.355600      -2.511400     -5.0000002E-04
 H   -4.508500     -0.3601000     -8.9999998E-04
 H    4.264900       1.570000      1.0000000E-03
 H  -0.1058000      -3.141200     -0.8927000    
 H  -0.1069000      -3.141400      0.8941000    
 H   -1.467900      -3.821200     -3.0000001E-04
 H   -2.777600       2.989700      9.6000005E-03
 H   -4.071600       2.198500     -0.8957000    
 H   -4.087200       2.190600      0.8841000    
 H    5.271100     -0.6012000     -0.4898000    
 H    4.740600      -1.365300       1.026500    
 H    4.298000      -2.067200     -0.5483000    


%chk=000155602-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000155602

0 1
N -0.412855 1.788414 0.001170
C -0.653533 -0.506947 0.004564
C -1.356583 0.746774 0.008917
C 0.774444 -0.188852 -0.005509
C 0.882467 1.245931 -0.010029
C -1.390553 -1.725694 0.011154
C -2.768982 0.851539 0.021276
C 1.964603 -0.961253 -0.009609
C 2.131496 1.900025 -0.019743
C -2.800367 -1.628167 0.023059
C -3.471025 -0.373319 0.028231
C 3.228047 -0.327124 -0.021222
C 3.291904 1.099770 -0.025906
C -0.699463 -3.075469 0.006374
C -3.464440 2.199328 0.025141
C 4.512383 -1.141610 -0.030960
H -0.635567 2.780419 -0.012479
H 1.915407 -2.054899 -0.006079
H 2.205477 2.993264 -0.022384
H -3.396017 -2.548715 0.028145
H -4.567753 -0.353830 0.038383
H 4.275703 1.585488 -0.034967
H -0.056106 -3.196638 -0.886277
H -0.050398 -3.200210 0.894519
H -1.434463 -3.898467 0.007189
H -3.183724 2.804849 0.910401
H -3.213632 2.794157 -0.875896
H -4.560510 2.077768 0.044318
H 5.121428 -0.928436 -0.930345
H 5.142967 -0.913895 0.849433
H 4.302245 -2.225301 -0.019969


