%chk=000023766.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000023766

0 1
 O    3.007900     -0.8571000     -0.8402000    
 O    2.840700      0.1961000       1.193700    
 N   0.6978000       1.637500      0.1547000    
 N    1.406400      0.6894000     -0.5626000    
 C  -0.6735000       1.715000     -0.3301000    
 C   -1.408000      0.4078000     -0.1244000    
 C   -1.391800       2.899100      0.3138000    
 C   -1.121200     -0.3598000      0.9909000    
 C   -2.350000      8.6000003E-03  -1.056300    
 C   -1.798000      -1.564700       1.180400    
 C   -3.026900      -1.196200     -0.8668000    
 C   -2.750900      -1.982900      0.2515000    
 C    2.453500      2.7799999E-02  4.1400000E-02
 C    4.113900      -1.620700     -0.3460000    
 H  -0.6376000       1.924200      -1.409600    
 H   -2.412400       2.995600     -7.3399998E-02
 H   -1.463100       2.783600       1.401700    
 H  -0.8682000       3.839200      0.1072000    
 H    1.166700       2.530800      6.3000000E-03
 H  -0.4036000     -5.0600000E-02   1.744800    
 H   -2.573700      0.6148000      -1.929100    
 H   -1.587300      -2.174700       2.054000    
 H   -3.769500      -1.521500      -1.589500    
 H    1.164300      0.5124000      -1.532400    
 H   -3.279000      -2.920200      0.3999000    
 H    3.800500      -2.233400      0.5046000    
 H    4.936100     -0.9565000     -6.3299999E-02
 H    4.455700      -2.281200      -1.147300    


%chk=000023766-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000023766

0 1
O 3.119802 -0.661887 -0.909010
O 2.336870 -0.239418 1.276764
N 0.722555 1.836412 0.051792
N 1.645253 1.016815 -0.616944
C -0.677485 1.775675 -0.437524
C -1.321622 0.413865 -0.168076
C -1.456774 2.911331 0.270106
C -0.996121 -0.335316 0.989266
C -2.309791 -0.078458 -1.055608
C -1.659974 -1.553869 1.255071
C -2.977389 -1.295118 -0.788004
C -2.654788 -2.036272 0.372464
C 2.340998 0.021649 0.054109
C 3.937275 -1.762434 -0.363126
H -0.723635 1.964332 -1.539908
H -2.513331 2.899402 -0.044470
H -1.419626 2.770223 1.364291
H -1.035039 3.905265 0.023781
H 1.072466 2.795308 0.174354
H -0.206631 0.027989 1.655952
H -2.557274 0.489685 -1.962281
H -1.395954 -2.129777 2.149338
H -3.739493 -1.666111 -1.482935
H 1.755224 1.059176 -1.637673
H -3.167560 -2.981972 0.582248
H 3.292750 -2.529332 0.099079
H 4.645619 -1.382464 0.392682
H 4.472476 -2.172298 -1.231837


