%chk=000155732.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000155732

1 1
 O    1.451300      -1.873800      -1.015200    
 N    3.379000     -4.2700000E-02 -0.1461000    
 C    4.350600      0.8903000      0.6488000    
 C    5.405100     -6.1799999E-02   1.214500    
 C    4.047900      -1.425200     -0.1854000    
 C    3.251000      0.5837000      -1.543500    
 C    4.815700       1.917100     -0.3824000    
 C    5.501600      -1.156200      0.1598000    
 C    3.644100       2.031500      -1.334300    
 C    2.020400     -0.1236000      0.5275000    
 C    6.744100      0.5752000       1.548900    
 C    1.062500     -0.9689000     -0.2803000    
 C  -0.3983000     -0.6863000     -0.1760000    
 C  -0.8904000     -0.1781000       1.004900    
 C   -1.199500     -0.9446000      -1.265400    
 C   -2.256700      8.5800000E-02   1.102000    
 C   -2.565700     -0.6808000      -1.168300    
 C   -3.094300     -0.1655000      1.5400000E-02
 C   -4.511700      0.1075000      0.1155000    
 C   -5.382400     -0.8835000      0.5687000    
 C   -5.007400       1.361900     -0.2405000    
 C   -6.748800     -0.6205000      0.6656000    
 C   -6.373900       1.624900     -0.1435000    
 C   -7.244500      0.6337000      0.3096000    
 H    3.777100       1.378200       1.446100    
 H    5.003700     -0.5049000       2.136900    
 H    3.925000      -1.879800      -1.172600    
 H    3.589000      -2.056700      0.5839000    
 H    2.239700      0.4761000      -1.942000    
 H    3.964300      8.2999997E-02  -2.207900    
 H    5.701100       1.576900     -0.9313000    
 H    5.062400       2.875800      8.3899997E-02
 H    5.999400      -2.054400      0.5381000    
 H    6.051000     -0.8150000     -0.7254000    
 H    2.824600       2.596600     -0.8755000    
 H    3.917000       2.523900      -2.271900    
 H    2.160300     -0.5537000       1.524700    
 H    1.650100      0.9039000      0.6074000    
 H    7.408200     -0.1598000       2.016200    
 H    7.254900      0.9576000      0.6600000    
 H    6.612500       1.404700       2.251100    
 H  -0.2616000      1.1400000E-02   1.868800    
 H  -0.8002000      -1.340400      -2.194200    
 H   -2.653100      0.4841000       2.033000    
 H   -3.204700     -0.8813000      -2.025300    
 H   -5.012600      -1.866600      0.8505000    
 H   -4.342600       2.145900     -0.5955000    
 H   -7.426800      -1.392100       1.018300    
 H   -6.760000       2.601400     -0.4207000    
 H   -8.308300      0.8385000      0.3851000    


%chk=000155732-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000155732

1 1
O 1.450328 -0.714220 -2.073799
N 3.484251 0.208281 -0.394321
C 4.455398 0.762058 0.752634
C 5.166372 -0.501677 1.307097
C 3.838701 -1.299421 -0.547601
C 3.839440 1.032812 -1.662929
C 5.325931 1.826000 0.048217
C 5.236651 -1.431759 0.068924
C 4.451603 2.331014 -1.122132
C 2.030107 0.416375 0.009787
C 6.513850 -0.229598 2.003059
C 1.016714 -0.193477 -0.998030
C -0.412702 -0.124773 -0.647469
C -0.895419 0.474104 0.554634
C -1.360883 -0.681330 -1.557205
C -2.269470 0.511202 0.831561
C -2.731443 -0.644397 -1.273085
C -3.224168 -0.048186 -0.071560
C -4.677004 -0.010170 0.229575
C -5.143788 -0.016992 1.575760
C -5.639929 0.030972 -0.819840
C -6.523121 0.013354 1.862143
C -7.019046 0.068969 -0.532468
C -7.467296 0.058666 0.809426
H 3.805017 1.239589 1.505854
H 4.489152 -0.977299 2.046700
H 3.735666 -1.575768 -1.604805
H 3.095963 -1.871554 0.033848
H 2.940937 1.134174 -2.284607
H 4.588355 0.448712 -2.222809
H 6.257176 1.380468 -0.344866
H 5.610690 2.626808 0.749275
H 5.453103 -2.477753 0.341741
H 6.027306 -1.103194 -0.631813
H 3.673478 3.034801 -0.773580
H 5.039338 2.847286 -1.898245
H 1.898518 -0.037107 1.008359
H 1.858714 1.504060 0.105570
H 6.934527 -1.174768 2.387733
H 7.257143 0.207869 1.314042
H 6.397981 0.454872 2.862147
H -0.207840 0.928665 1.277289
H -0.990080 -1.147626 -2.475623
H -2.618684 1.007318 1.742350
H -3.434430 -1.109384 -1.970945
H -4.428974 -0.087336 2.403200
H -5.310845 0.071640 -1.864042
H -6.863839 -0.007247 2.902514
H -7.744186 0.113797 -1.351557
H -8.539162 0.084565 1.031888


