%chk=000022405.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000022405

1 1
 O   -3.285600      -1.900000      0.9101000    
 O    3.578100     -0.9898000      0.2479000    
 O    2.959100      -2.806600     -0.9229000    
 N  -0.5695000       2.106700      7.8800000E-02
 C  -0.5265000      0.5045000     -5.3900000E-02
 C   0.2922000       2.633900       1.205900    
 C  -0.1095000       2.527800      -1.353400    
 C   0.8910000     -5.5900000E-02  0.2772000    
 C   -1.628500     -0.1643000      0.8112000    
 C  -0.8524000      0.3219000      -1.535000    
 C    1.726100       2.157000       1.124400    
 C   -1.980700       2.695900      0.2880000    
 C    1.874500      0.7063000      0.7890000    
 C  -0.5462000       1.411800      -2.252000    
 C   -2.008300      -1.589400      0.3488000    
 C    1.201600      -1.512100      5.5100001E-02
 C   -1.543100     -0.8478000      -2.006000    
 C   -2.074100      -1.735300      -1.150900    
 C    3.227000      0.1293000       1.078400    
 C    2.644900      -1.818300     -0.2634000    
 C   -3.270000      -1.775700       2.322800    
 H  -0.1663000       2.290100       2.141400    
 H   0.2495000       3.728900       1.178300    
 H   0.9769000       2.639300      -1.372000    
 H  -0.5842000       3.481400      -1.602600    
 H   -2.556000      0.4155000      0.7882000    
 H   -1.302600     -0.1691000       1.859300    
 H    2.196100       2.355100       2.096400    
 H    2.286000       2.751900      0.3932000    
 H   -1.911400       3.783900      0.1870000    
 H   -2.656600       2.292300     -0.4706000    
 H   -2.318400       2.452500       1.299100    
 H  -0.7166000       1.532200      -3.312300    
 H   -1.295400      -2.329700      0.7258000    
 H   0.9252000      -2.093300      0.9406000    
 H   0.6478000      -1.892800     -0.8047000    
 H   -1.651500     -0.9930000      -3.076000    
 H   -2.575200      -2.613200      -1.549900    
 H    3.998500      0.8851000      0.8938000    
 H    3.306300     -0.1750000       2.127600    
 H   -4.142800      -2.310400       2.710300    
 H   -3.374000     -0.7326000       2.635200    
 H   -2.378300      -2.231400       2.765800    


%chk=000022405-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000022405

1 1
O -3.363490 -1.825866 1.103632
O 3.555303 -0.717312 -0.071824
O 2.833166 -2.283270 -1.586677
N -0.497456 2.159903 -0.027688
C -0.577307 0.555369 -0.018082
C 0.254982 2.718022 1.186839
C 0.175344 2.438707 -1.404277
C 0.821281 0.021499 0.353438
C -1.701784 -0.003170 0.886625
C -0.872202 0.309451 -1.511387
C 1.701440 2.228547 1.265562
C -1.881198 2.807775 -0.041209
C 1.816601 0.765856 0.913612
C -0.391802 1.335016 -2.272170
C -2.061848 -1.484528 0.528147
C 1.171716 -1.426907 0.018191
C -1.621979 -0.876973 -1.900804
C -2.186230 -1.700293 -0.965689
C 3.164295 0.097050 1.110247
C 2.562663 -1.541481 -0.632140
C -3.320337 -2.223033 2.520278
H -0.320177 2.385864 2.068600
H 0.198369 3.818345 1.129714
H 1.270523 2.368570 -1.284766
H -0.085983 3.458666 -1.732072
H -2.645607 0.544042 0.721987
H -1.427132 0.070278 1.953996
H 2.062106 2.410640 2.297033
H 2.369769 2.829103 0.616057
H -1.747714 3.885972 -0.221649
H -2.488729 2.368684 -0.844643
H -2.371280 2.663303 0.931739
H -0.423531 1.406812 -3.360953
H -1.293064 -2.178181 0.939942
H 1.194818 -2.036511 0.946765
H 0.463375 -1.903426 -0.672352
H -1.750088 -1.080450 -2.969475
H -2.776557 -2.573877 -1.262342
H 3.980058 0.829354 1.215471
H 3.167480 -0.559021 2.004504
H -4.336076 -2.571876 2.756927
H -3.065112 -1.372921 3.184542
H -2.599507 -3.050129 2.680354


