%chk=000051886.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000051886

0 1
 O    1.641500       1.081200     -0.1951000    
 O    3.906900      -1.623000     -0.1766000    
 O   0.6745000     -0.9324000     -0.6751000    
 O    2.779600     -0.7168000       1.572700    
 N  -0.5752000      0.9260000      2.1299999E-02
 C    2.923600      0.5256000     -0.5109000    
 C   -1.876800      0.4234000      2.7100001E-02
 C    3.964900       1.616300     -0.3310000    
 C   -2.940700       1.247200      0.3954000    
 C   -2.114600     -0.9022000     -0.3362000    
 C   0.5711000      0.2347000     -0.3183000    
 C    3.183000     -0.6407000      0.4194000    
 C   -4.242100      0.7451000      0.4008000    
 C   -3.416000      -1.404000     -0.3309000    
 C   -4.479700     -0.5803000      3.7599999E-02
 H    2.909900      0.1843000      -1.552800    
 H    3.965300       1.992400      0.6984000    
 H    3.745600       2.469300     -0.9817000    
 H    4.969600       1.246500     -0.5584000    
 H  -0.4594000       1.898500      0.2946000    
 H   -2.769900       2.282100      0.6806000    
 H   -1.353600      -1.608400     -0.6342000    
 H   -5.070500       1.386300      0.6877000    
 H   -3.602900      -2.436100     -0.6135000    
 H   -5.493000     -0.9712000      4.1800000E-02
 H    4.063700      -2.379500      0.4279000    


%chk=000051886-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000051886

0 1
O 1.645039 0.999269 -0.145858
O 4.519912 -1.253204 0.238921
O 0.632670 -0.972220 -0.961353
O 2.749850 -0.819982 1.688207
N -0.588881 0.771365 0.093325
C 2.958351 0.421920 -0.466682
C -1.936577 0.317379 0.032234
C 3.952949 1.587844 -0.551521
C -2.933612 1.162093 0.589091
C -2.305111 -0.922306 -0.553046
C 0.537700 0.138705 -0.386784
C 3.344952 -0.593068 0.619196
C -4.287829 0.772631 0.560717
C -3.666217 -1.295831 -0.573545
C -4.664250 -0.459956 -0.022322
H 2.896776 -0.126324 -1.424823
H 3.989984 2.140559 0.402448
H 3.638821 2.282005 -1.348369
H 4.959692 1.204023 -0.784342
H -0.413984 1.665160 0.557976
H -2.648579 2.119829 1.043220
H -1.535802 -1.571903 -0.975502
H -5.047341 1.432501 0.994285
H -3.945706 -2.254088 -1.025617
H -5.716348 -0.762708 -0.044606
H 4.768340 -1.919394 0.935348


