%chk=000051433.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000051433

0 1
 O   -2.261100       1.134800      0.7603000    
 O   -1.303700     -8.3899997E-02   2.443600    
 N    1.119200      0.8661000      -1.141200    
 C  -0.5598000     -0.3943000      0.1320000    
 C   -1.452700     -5.5599999E-02  -1.065100    
 C  -0.4494000      -1.910800      0.3341000    
 C   -2.078100       1.261100     -0.6545000    
 C   -1.388800      0.2025000       1.257900    
 C   0.8263000      0.2568000      2.8000001E-02
 C   0.3181000      -2.570200     -0.8086000    
 C   -3.413700       1.524500      -1.324100    
 C    1.687300      0.1901000       1.109500    
 C   0.4036000      -4.076700     -0.6221000    
 C    2.935200      0.7900000      0.9826000    
 C    2.341300       1.437800      -1.227500    
 C    3.276200       1.427800     -0.2049000    
 H   -2.244100     -0.8124000      -1.161400    
 H  -0.9575000     -1.7000000E-03  -2.039500    
 H   -1.450300      -2.356700      0.4128000    
 H   4.9800001E-02  -2.143900       1.283800    
 H   -1.404700       2.107000     -0.8351000    
 H    1.339800      -2.181900     -0.8764000    
 H  -0.1705000      -2.368200      -1.768100    
 H   -3.306200       1.587900      -2.411000    
 H   -4.138500      0.7384000      -1.085400    
 H   -3.842300       2.463700     -0.9585000    
 H    1.421900     -0.3074000       2.035400    
 H   0.9225000      -4.328100      0.3085000    
 H  -0.5943000      -4.525900     -0.5920000    
 H   0.9550000      -4.531000      -1.451300    
 H    3.640800      0.7604000       1.807500    
 H    2.558200       1.922000      -2.173900    
 H    4.243300       1.902100     -0.3263000    


%chk=000051433-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000051433

0 1
O -2.264939 1.172759 0.799903
O -1.216374 -0.042376 2.473918
N 1.206235 0.859274 -1.164976
C -0.567516 -0.395774 0.066657
C -1.460150 -0.016529 -1.140135
C -0.423226 -1.932473 0.283355
C -2.147602 1.295729 -0.707771
C -1.344474 0.224558 1.265343
C 0.824311 0.277610 0.011843
C 0.301968 -2.659665 -0.869908
C -3.541823 1.544044 -1.270476
C 1.672820 0.259435 1.150783
C 0.411018 -4.178292 -0.614825
C 2.954253 0.840502 1.060680
C 2.449124 1.419075 -1.238722
C 3.359433 1.429558 -0.160193
H -2.222426 -0.801603 -1.302605
H -0.868471 0.127378 -2.056318
H -1.437414 -2.361442 0.411719
H 0.109967 -2.110102 1.236919
H -1.479988 2.159236 -0.886611
H 1.314345 -2.231065 -1.002788
H -0.238055 -2.481890 -1.820968
H -3.487842 1.641080 -2.370408
H -4.216376 0.705060 -1.025020
H -3.975452 2.472181 -0.861028
H 1.317362 -0.183062 2.086640
H 0.973986 -4.385548 0.314674
H -0.589819 -4.637928 -0.508679
H 0.930840 -4.688940 -1.445795
H 3.622711 0.839371 1.928191
H 2.710650 1.873904 -2.201206
H 4.345722 1.890235 -0.273093


