%chk=000122712.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122712

0 1
 O   0.6727000     -0.6758000      2.3600001E-02
 O   0.9761000       1.633800     -5.0900001E-02
 O   -5.440900      0.1858000      -1.104400    
 O   -5.439700      0.2621000       1.089400    
 N   -4.838700      0.1354000     -4.6999999E-03
 N    3.200600      -1.090700      2.9300001E-02
 N    5.110400      0.9626000     -2.6100000E-02
 C  -0.6739000     -0.4777000      1.6899999E-02
 C   -3.434000     -7.2099999E-02  1.7000000E-03
 C   -1.363800     -0.4191000      -1.194100    
 C   -1.364200     -0.3334000       1.220400    
 C   -2.743800     -0.2163000      -1.201700    
 C   -2.744300     -0.1306000       1.212800    
 C    2.883100      0.2030000     -8.2999999E-03
 C    1.427700      0.4989000     -1.8400000E-02
 C    3.787200       1.218500     -3.5599999E-02
 C    4.523900      -1.346500      3.8699999E-02
 C    5.461900     -0.3380000      1.1500000E-02
 H  -0.8318000     -0.5314000      -2.135000    
 H  -0.8326000     -0.3786000       2.167100    
 H   -3.248100     -0.1761000      -2.163800    
 H   -3.248800     -2.2399999E-02   2.169600    
 H    3.516000       2.266200     -6.5800004E-02
 H    4.807100      -2.391300      6.8999998E-02
 H    6.524900     -0.5444000      1.9099999E-02


%chk=000122712-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000122712

0 1
O 0.660845 -0.547532 0.023999
O 1.099222 1.754924 -0.050910
O -5.592560 0.022585 -1.146496
O -5.595299 0.108539 1.132902
N -4.991034 0.014819 -0.004165
N 3.297966 -1.143162 0.032262
N 5.269792 0.933061 -0.027439
C -0.750968 -0.338590 0.014765
C -3.511932 -0.107974 0.002321
C -1.429129 -0.328386 -1.221768
C -1.432614 -0.237009 1.245238
C -2.831625 -0.210715 -1.231239
C -2.835112 -0.119045 1.242021
C 2.955085 0.180801 -0.002511
C 1.508701 0.576813 -0.011123
C 3.933668 1.211441 -0.031917
C 4.631937 -1.417255 0.036765
C 5.609785 -0.390553 0.006989
H -0.862418 -0.416571 -2.152705
H -0.868544 -0.255680 2.181763
H -3.402395 -0.197883 -2.162879
H -3.408442 -0.037223 2.168554
H 3.635590 2.263223 -0.059317
H 4.917146 -2.473610 0.064607
H 6.679334 -0.623116 0.010584


