%chk=000099793.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099793

0 1
 N   0.3244000      0.4441000     -0.3396000    
 N   -3.358500     -0.1074000     -0.2270000    
 C    2.159800      0.5641000       1.142000    
 C    2.537200       1.258200     -0.2038000    
 C    3.033300     -0.7209000       1.114300    
 C    3.572900      0.2721000     -0.8122000    
 C    4.308900     -0.1674000      0.4622000    
 C   0.6430000      0.4075000       1.091400    
 C    1.210400       1.451900     -0.9314000    
 C    2.607000      -1.647000      9.9999997E-05
 C    2.930800      -1.050800      -1.156400    
 C   -1.081900      0.7127000     -0.5956000    
 C   -1.947000     -0.3862000      1.4400000E-02
 C   -3.740100       1.172300      0.3724000    
 C   -4.194200      -1.185900      0.3027000    
 C   -5.191500       1.507500      7.3399998E-02
 C   -3.814400      -2.524700     -0.3069000    
 H    2.454800       1.194000       1.990500    
 H    3.016800       2.226100     -1.1200000E-02
 H    3.185500      -1.207700       2.078500    
 H    4.213800      0.6846000      -1.592500    
 H    4.756400      0.6655000       1.016800    
 H    5.078600     -0.9299000      0.2847000    
 H   0.3357000     -0.5235000       1.577500    
 H   0.1790000       1.249500       1.621400    
 H   0.8400000       2.465800     -0.7317000    
 H    1.308500       1.330000      -2.014900    
 H    2.088400      -2.585200      0.1145000    
 H    2.722000      -1.419000      -2.148000    
 H   -1.300900       1.703200     -0.1889000    
 H   -1.256600      0.7530000      -1.678400    
 H   -1.635200      -1.322200     -0.4619000    
 H   -1.778600     -0.4895000       1.092700    
 H   -3.186500       2.005500     -6.5899998E-02
 H   -3.567700       1.189200       1.455800    
 H   -5.243700      -1.026600      3.4499999E-02
 H   -4.137500      -1.250300       1.396700    
 H   -5.428100       1.379800     -0.9885000    
 H   -5.889800      0.9106000      0.6681000    
 H   -5.386500       2.556000      0.3266000    
 H   -3.717300      -2.464500      -1.396400    
 H   -2.889100      -2.930100      0.1142000    
 H   -4.598900      -3.259300     -9.1600001E-02


%chk=000099793-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000099793

0 1
N 0.334197 0.466765 -0.202540
N -3.426995 -0.128479 0.056559
C 2.380886 0.885222 1.005491
C 2.632407 1.117458 -0.535449
C 3.261214 -0.398127 1.315430
C 3.614073 -0.069883 -0.912526
C 4.485127 -0.099911 0.387388
C 0.844657 0.765800 1.159801
C 1.227655 1.138371 -1.181418
C 2.648366 -1.591109 0.574944
C 2.858023 -1.393271 -0.758657
C -1.103474 0.694259 -0.424778
C -1.981425 -0.314525 0.347209
C -4.043569 0.939234 0.891294
C -4.193534 -1.402962 0.095076
C -5.281461 1.578996 0.233681
C -3.957411 -2.282797 -1.147790
H 2.766442 1.723788 1.613676
H 3.159093 2.070829 -0.723906
H 3.467459 -0.544972 2.387423
H 4.142227 0.079963 -1.867430
H 4.981084 0.864676 0.607542
H 5.227952 -0.915299 0.385314
H 0.559360 -0.034987 1.868633
H 0.422811 1.727282 1.555187
H 0.915929 2.198138 -1.370717
H 1.195359 0.605622 -2.151858
H 2.050625 -2.379681 1.038865
H 2.462293 -1.990091 -1.584247
H -1.402899 1.743835 -0.157525
H -1.321022 0.566977 -1.500970
H -1.672482 -1.326188 0.030715
H -1.775615 -0.247073 1.444271
H -3.281766 1.725595 1.046126
H -4.311986 0.555869 1.909847
H -5.268355 -1.149063 0.143822
H -3.965502 -1.989008 1.022509
H -5.009603 2.007273 -0.746718
H -6.088876 0.842402 0.069707
H -5.688284 2.383845 0.874567
H -4.244967 -1.732908 -2.060832
H -2.896844 -2.576732 -1.248680
H -4.557968 -3.210034 -1.086434


