%chk=000116658.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000116658

1 1
 N    2.951400       1.005100      -1.187200    
 N   -1.345100     -0.1430000     -3.4299999E-02
 N   -2.180800      0.9005000     -6.1900001E-02
 C    3.024700       1.095100       1.163600    
 C    4.408500       1.024400      0.5839000    
 C    2.203500       1.085800     -0.1314000    
 C    4.307700      0.9698000     -0.8054000    
 C    2.719600     -0.1334000       2.024200    
 C    2.814100       2.394300       1.944600    
 C    5.645400       1.006900       1.205900    
 C   0.7370000       1.156200     -0.1130000    
 C    5.426200      0.8974000      -1.618600    
 C    2.593700      0.9602000      -2.613500    
 C    6.786400      0.9336000      0.4031000    
 C    6.677400      0.8794000     -0.9970000    
 C   5.1199999E-02  9.6000005E-03 -6.0400002E-02
 C   -1.952600      -1.355500      1.9800000E-02
 C   -3.299900      -1.088700      2.8800000E-02
 C   -3.380900      0.3159000     -2.2900000E-02
 C   -1.273300      -2.631800      5.7900000E-02
 C   -4.582700       1.108500     -3.5700001E-02
 C  -0.9646000      -3.288400      -1.131400    
 C  -0.9308000      -3.200000       1.282800    
 C   -5.746100      0.5953000     -0.6045000    
 C   -4.577200       2.385600      0.5207000    
 C  -0.3104000      -4.519700      -1.095600    
 C  -0.2764000      -4.431500       1.318500    
 C   3.3799998E-02  -5.091200      0.1293000    
 C   -6.910300       1.363500     -0.6173000    
 C   -5.741600       3.153600      0.5079000    
 C   -6.908100       2.642400     -6.1000001E-02
 H    3.409100     -0.2067000       2.873200    
 H    1.703000     -9.4300002E-02   2.430900    
 H    2.807400      -1.062800       1.448900    
 H    1.787900       2.467600       2.322000    
 H    3.490300       2.459500       2.804600    
 H    2.991700       3.275300       1.316100    
 H    5.734400       1.048100       2.285900    
 H   0.2725000       2.134000     -0.1411000    
 H    5.360700      0.8553000      -2.700100    
 H    2.952900      1.8700000E-02  -3.038800    
 H    3.045400       1.817900      -3.120000    
 H    1.507300       1.012500      -2.721700    
 H    7.770000      0.9183000      0.8649000    
 H    7.578400      0.8229000      -1.602000    
 H   0.6219000     -0.9151000     -3.9700001E-02
 H   -4.099500      -1.815500      7.2999999E-02
 H   -1.225700      -2.855700      -2.094200    
 H   -1.164800      -2.697800       2.218400    
 H   -5.776600     -0.3934000      -1.055100    
 H   -3.686000       2.807700      0.9787000    
 H  -6.8499997E-02  -5.033300      -2.021400    
 H  -7.8999996E-03  -4.876400       2.272200    
 H   0.5435000      -6.049800      0.1571000    
 H   -7.818200      0.9668000      -1.062400    
 H   -5.740800       4.148900      0.9426000    
 H   -7.814600       3.240500     -7.1099997E-02


%chk=000116658-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000116658

1 1
N 3.296817 -0.052444 -0.181178
N -1.207287 -0.627032 -0.076133
N -1.942602 0.500797 0.336938
C 2.903662 2.020395 0.910899
C 4.394615 1.794571 0.684928
C 2.294992 0.738756 0.308677
C 4.587808 0.552584 0.035638
C 2.560080 2.132582 2.428464
C 2.391776 3.280572 0.145476
C 5.502986 2.591350 1.008920
C 0.891966 0.519237 0.305422
C 5.860467 0.061950 -0.307160
C 3.127737 -1.344123 -0.864894
C 6.798159 2.121567 0.672726
C 6.971608 0.873865 0.024351
C 0.168032 -0.587948 -0.126576
C -2.060089 -1.690101 -0.521229
C -3.349170 -1.196940 -0.399378
C -3.246757 0.151099 0.138473
C -1.562095 -3.000348 -0.980229
C -4.340647 1.074022 0.459866
C -2.047340 -3.543930 -2.200813
C -0.640967 -3.758469 -0.201921
C -5.693958 0.708256 0.212627
C -4.061528 2.351988 1.024520
C -1.612325 -4.812351 -2.639395
C -0.207122 -5.025916 -0.646450
C -0.687742 -5.554399 -1.867642
C -6.741561 1.598057 0.523283
C -5.110225 3.237409 1.333338
C -6.454475 2.864500 1.084215
H 3.050933 3.027178 2.848790
H 1.472000 2.237367 2.581975
H 2.912695 1.250758 2.990191
H 1.302591 3.407537 0.272512
H 2.888442 4.179174 0.550166
H 2.616714 3.219327 -0.933037
H 5.380660 3.556923 1.510554
H 0.289641 1.339136 0.709126
H 6.015414 -0.900184 -0.804202
H 2.739908 -2.108879 -0.168732
H 4.097948 -1.686218 -1.248555
H 2.438050 -1.237159 -1.720320
H 7.675888 2.727820 0.916967
H 7.979967 0.528929 -0.224421
H 0.610217 -1.497788 -0.533028
H -4.258322 -1.749717 -0.621014
H -2.752246 -2.964426 -2.806841
H -0.316246 -3.387277 0.777817
H -5.933584 -0.267818 -0.222445
H -3.021168 2.632478 1.215526
H -1.992077 -5.220525 -3.581559
H 0.483169 -5.611605 -0.030253
H -0.355590 -6.540641 -2.207794
H -7.778994 1.307225 0.329714
H -4.887602 4.217275 1.768233
H -7.269619 3.554654 1.325666


