%chk=000092743.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000092743

0 1
 O    2.083500       2.180600      0.4837000    
 O    3.630100      -2.399300      6.6999998E-03
 O   -4.321200     -0.3419000     -0.9475000    
 O   -4.101200     -0.6602000       1.217700    
 N    4.237600      0.3515000      0.1894000    
 N   -3.626500     -0.3590000      9.6600004E-02
 C    1.903800      0.9771000     -0.2682000    
 C    2.847700     -0.1254000      0.2625000    
 C   0.4353000      0.6233000     -0.1714000    
 C    2.744800      -1.427700     -0.5415000    
 C  -0.3403000      0.6398000      -1.317300    
 C  -9.8899998E-02  0.2902000       1.061000    
 C   -1.693400      0.3130000      -1.228000    
 C   -1.452000     -3.6699999E-02   1.150400    
 C   -2.249300     -2.5300000E-02  5.7999999E-03
 H    2.169000       1.212000      -1.307300    
 H    2.658000     -0.3300000       1.322400    
 H    3.014000      -1.276200      -1.592400    
 H    1.733700      -1.845000     -0.5086000    
 H   8.1799999E-02  0.9010000      -2.283300    
 H   0.5048000      0.2865000       1.963500    
 H    4.316900       1.237200      0.6882000    
 H    4.480600      0.5532000     -0.7801000    
 H   -2.283400      0.3323000      -2.140700    
 H   -1.850800     -0.2930000       2.128700    
 H    1.434500       2.833600      0.1696000    
 H    3.366900      -2.545800      0.9312000    


%chk=000092743-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000092743

0 1
O 2.247380 2.087463 0.724011
O 3.611226 -2.454866 -0.223449
O -4.377809 -0.591762 -1.024343
O -4.305535 -0.398277 1.248098
N 4.241946 0.149982 0.274995
N -3.753553 -0.353828 0.081259
C 1.894611 0.993114 -0.203660
C 2.803377 -0.191753 0.242737
C 0.412585 0.660378 -0.138606
C 2.649699 -1.447730 -0.650534
C -0.324082 0.390329 -1.320753
C -0.243888 0.593180 1.120111
C -1.690073 0.053530 -1.259373
C -1.607833 0.258509 1.201662
C -2.312760 -0.007154 0.006046
H 2.165352 1.274931 -1.246495
H 2.516413 -0.462021 1.276857
H 2.812780 -1.169793 -1.719811
H 1.644173 -1.889065 -0.555286
H 0.173342 0.447900 -2.296025
H 0.323647 0.816922 2.029139
H 4.475587 0.800965 1.032479
H 4.593086 0.504572 -0.625495
H -2.276729 -0.156065 -2.157481
H -2.133571 0.199682 2.158329
H 1.686386 2.878911 0.522105
H 4.400241 -1.922252 0.094584


