%chk=000152550.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000152550

0 1
 O   -1.842100      0.4906000      0.7552000    
 O   -3.993400       1.244500      0.4940000    
 O    1.107100      -2.328500      0.5026000    
 N   0.2983000     -0.2046000      0.1118000    
 N    2.640700     -0.6931000      0.1484000    
 N    4.207000      0.9874000     -0.2135000    
 C   -1.076900     -0.5943000      0.2207000    
 C   -1.716500     -0.8976000      -1.112700    
 C   -3.172200     -0.6012000     -0.8438000    
 C   -3.086000      0.4883000      0.1840000    
 C   0.5733000       1.117800     -0.1489000    
 C    1.336000      -1.140600      0.2670000    
 C    1.821100       1.568200     -0.2653000    
 C    2.903400      0.5632000     -9.9500000E-02
 H   -1.172900      -1.444400      0.9073000    
 H   -1.537600      -1.922800      -1.450100    
 H   -1.348300     -0.2243000      -1.897300    
 H   -3.689200      -1.461700     -0.4098000    
 H   -3.684500     -0.2549000      -1.744100    
 H  -0.2522000       1.806400     -0.2869000    
 H    2.059700       2.601200     -0.4803000    
 H    4.443000       1.955200     -0.4060000    
 H    4.977400      0.3360000     -0.1081000    


%chk=000152550-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000152550

0 1
O -1.936585 0.604689 0.681768
O -4.090923 1.361261 0.243542
O 0.927242 -2.299724 0.114540
N 0.300165 -0.047334 0.110365
N 2.635491 -0.682781 -0.065287
N 4.272617 0.946525 -0.273109
C -1.085280 -0.535818 0.263079
C -1.727276 -1.077604 -1.042103
C -3.217727 -0.714842 -0.871234
C -3.209303 0.522371 0.029626
C 0.623025 1.288389 0.021838
C 1.324055 -1.098391 0.054370
C 1.940702 1.681075 -0.120098
C 2.938972 0.632808 -0.152817
H -1.083737 -1.298306 1.060045
H -1.528838 -2.152834 -1.151311
H -1.292849 -0.552027 -1.910423
H -3.780880 -1.512650 -0.350971
H -3.746954 -0.494312 -1.810823
H -0.206014 1.995684 0.095558
H 2.200810 2.739242 -0.180901
H 4.596801 1.907386 -0.337753
H 4.941686 0.177992 -0.283200


