%chk=000068700.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000068700

0 1
 O    1.607400       2.093100     -0.3286000    
 O   -6.459300      0.1989000      0.7097000    
 O   -4.510700      0.9049000       1.626500    
 N    1.246600     -0.2363000     -6.0400002E-02
 C    2.112200      -1.401300      0.1377000    
 C    3.476700     -0.8054000      0.1480000    
 C    3.403500      0.5719000     -2.7100001E-02
 C  -0.1397000     -0.2969000     -0.1387000    
 C    1.992300      0.9494000     -0.1614000    
 C   -2.927800     -0.4194000     -0.2962000    
 C   -4.415400     -0.4844000     -0.3802000    
 C  -0.7968000      -1.525300     -2.6900001E-02
 C  -0.8847000      0.8699000     -0.3296000    
 C    4.701700      -1.427600      0.3015000    
 C   -2.188200      -1.586400     -0.1056000    
 C   -2.276100      0.8089000     -0.4082000    
 C    4.525300       1.379100     -5.7300001E-02
 C    5.853300     -0.6346000      0.2750000    
 C    5.765400      0.7577000      9.7000003E-02
 C   -4.982100      1.3000000E-03  -1.729900    
 C   -5.103300      0.2824000      0.7547000    
 H    1.993000      -2.096100     -0.6995000    
 H    1.882000      -1.872700       1.098300    
 H   -4.727600      -1.530200     -0.2514000    
 H  -0.2570000      -2.456000      0.1220000    
 H  -0.4773000       1.864300     -0.4278000    
 H    4.774100      -2.500900      0.4391000    
 H   -2.680000      -2.551500     -1.6400000E-02
 H   -2.836000       1.728500     -0.5579000    
 H    4.454600       2.451900     -0.1945000    
 H    6.829000      -1.098500      0.3934000    
 H    6.673700       1.354000      7.9700001E-02
 H   -4.844200       1.080500      -1.860200    
 H   -4.487000     -0.5071000      -2.564500    
 H   -6.055800     -0.2023000      -1.804500    
 H   -6.880100      0.6926000       1.445500    


%chk=000068700-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000068700

0 1
O 1.651516 2.240769 -0.306946
O -5.578865 -0.435746 1.684992
O -5.460991 1.580224 0.541068
N 1.235348 -0.115321 -0.060113
C 2.050157 -1.341822 0.140123
C 3.472518 -0.819347 0.178898
C 3.452610 0.582171 0.012701
C -0.183437 -0.181986 -0.156403
C 2.047481 1.052558 -0.140198
C -3.032899 -0.371782 -0.358160
C -4.557433 -0.483936 -0.509875
C -0.837176 -1.442601 -0.075104
C -0.976983 0.988986 -0.330787
C 4.689109 -1.504385 0.343471
C -2.240478 -1.527886 -0.172867
C -2.376449 0.883596 -0.428778
C 4.636228 1.345290 0.004569
C 5.887386 -0.746829 0.336829
C 5.862877 0.662817 0.169108
C -5.038159 -0.025327 -1.910256
C -5.234294 0.350704 0.575659
H 1.892516 -2.055566 -0.692267
H 1.766264 -1.848461 1.083419
H -4.847487 -1.535284 -0.339874
H -0.264731 -2.364256 0.065048
H -0.486063 1.962136 -0.386462
H 4.721080 -2.591915 0.473661
H -2.721855 -2.510620 -0.102762
H -2.967848 1.798428 -0.551307
H 4.588626 2.431139 -0.126270
H 6.849038 -1.256538 0.463175
H 6.804711 1.221960 0.168014
H -4.819862 1.044526 -2.065581
H -4.521713 -0.607266 -2.692711
H -6.127678 -0.170562 -2.022905
H -5.971365 0.148532 2.390189


