%chk=000048930.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000048930

0 1
 O   -1.158400      0.4362000      2.4700001E-02
 O   -2.416700       2.257500      0.6240000    
 N    3.672300      0.2342000     -0.3231000    
 C    3.735500     -0.9114000      0.5955000    
 C    4.924900       1.002700     -0.3007000    
 C    4.887700      -1.848700      0.2304000    
 C    6.115900      0.1280000     -0.6950000    
 C    6.217800      -1.104900      0.1960000    
 C    2.537900       1.095300      1.0200000E-02
 C    1.229000      0.3250000     -0.1315000    
 C   2.6600000E-02   1.202900      0.1882000    
 C   -2.342900       1.083600      0.2759000    
 C   -3.487200      0.1934000      7.5000003E-02
 C   -4.705600      0.7214000     -0.3363000    
 C   -3.344500      -1.171600      0.2971000    
 C   -5.796200     -0.1267000     -0.5281000    
 C   -4.435200      -2.019700      0.1052000    
 C   -5.660900      -1.497300     -0.3073000    
 H    2.841200      -1.536500      0.5394000    
 H    3.844600     -0.5775000       1.635700    
 H    5.099800       1.435900      0.6930000    
 H    4.863600       1.834700      -1.012600    
 H    4.697400      -2.301700     -0.7510000    
 H    4.943100      -2.668800      0.9554000    
 H    7.041600      0.7106000     -0.6269000    
 H    6.011300     -0.1851000      -1.741600    
 H    6.493000     -0.7998000       1.213000    
 H    7.010600      -1.767600     -0.1677000    
 H    2.630700       1.498600       1.027000    
 H    2.512100       1.950300     -0.6772000    
 H    1.125500     -8.2000002E-02  -1.145600    
 H    1.161600     -0.5282000      0.5502000    
 H  -5.0000002E-04   2.062800     -0.4914000    
 H   8.8699996E-02   1.563600       1.221700    
 H   -4.825400       1.786600     -0.5150000    
 H   -2.405500      -1.604400      0.6309000    
 H   -6.750600      0.2798000     -0.8499000    
 H   -4.331100      -3.086700      0.2798000    
 H   -6.510200      -2.157700     -0.4561000    


%chk=000048930-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000048930

0 1
O -1.207134 0.387935 -0.076277
O -2.463803 2.273754 0.468898
N 3.732408 0.129557 -0.189565
C 3.962381 -0.820593 0.929688
C 4.960386 0.918122 -0.477419
C 5.110398 -1.799109 0.605811
C 6.138711 -0.003413 -0.851355
C 6.408774 -1.030434 0.271481
C 2.556980 1.006251 0.037012
C 1.214000 0.256978 -0.112076
C 0.030070 1.207035 0.071371
C -2.413317 1.058265 0.151691
C -3.595470 0.165316 -0.027208
C -4.885084 0.717497 0.187821
C -3.461867 -1.196769 -0.403421
C -6.032471 -0.085895 0.027881
C -4.613276 -1.996564 -0.562786
C -5.898625 -1.444232 -0.347988
H 3.033637 -1.388525 1.115255
H 4.207973 -0.265474 1.875952
H 5.254726 1.546362 0.406565
H 4.739857 1.608985 -1.312964
H 4.813622 -2.419763 -0.261670
H 5.267435 -2.477317 1.466698
H 7.038763 0.611777 -1.044432
H 5.888201 -0.536736 -1.788729
H 6.765813 -0.499072 1.178330
H 7.210082 -1.732036 -0.028291
H 2.599815 1.503377 1.043101
H 2.595891 1.816359 -0.717966
H 1.175484 -0.208855 -1.112988
H 1.130685 -0.555300 0.632909
H 0.009572 2.008899 -0.690578
H 0.019980 1.683483 1.069642
H -4.961619 1.770884 0.477171
H -2.462733 -1.609896 -0.567156
H -7.026963 0.341848 0.194519
H -4.511121 -3.047519 -0.854431
H -6.790663 -2.068384 -0.473198


