%chk=000134992.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000134992

0 1
 O   -3.147800      7.0100002E-02 -0.3593000    
 O   -4.633400       2.330400     -0.9625000    
 O  -0.8666000     -0.3219000      -1.691800    
 N   -1.235600       2.894500      0.3484000    
 C   -3.603000       2.412300      2.3800001E-02
 C   -2.302700       2.853900     -0.6414000    
 C   1.2700000E-02   3.351400     -0.2510000    
 C    1.125200       3.378400      0.7957000    
 C   -3.455200       1.028100      0.6486000    
 C    2.449700       3.834700      0.1828000    
 C   0.8016000      -1.580500     -0.4907000    
 C   -2.964700      -1.222100      5.5100001E-02
 C    1.790800     -0.4291000     -0.6855000    
 C   -1.754000      -1.872500     -0.1627000    
 C  -0.6499000      -1.202300     -0.8355000    
 C    3.554000       3.898400       1.225700    
 C    3.199900     -0.8417000     -0.3463000    
 C   -4.010700      -1.875700      0.6997000    
 C   -1.587500      -3.188700      0.2678000    
 C   -2.632800      -3.848500      0.9144000    
 C   -3.844400      -3.192000       1.130400    
 C    3.663000     -0.6843000      0.9519000    
 C    4.012400      -1.372400      -1.337500    
 C    4.967500      -1.065800       1.265700    
 C    5.316900      -1.754100      -1.023600    
 C    5.794400      -1.600800      0.2780000    
 H   -3.919700       3.137200      0.7816000    
 H   -2.457500       3.844200      -1.088900    
 H   -2.047800       2.182200      -1.470000    
 H   0.3034000       2.677600      -1.066100    
 H  -0.1141000       4.355600     -0.6734000    
 H    1.248800       2.384300       1.241900    
 H   0.8483000       4.060500       1.609800    
 H   -1.496600       3.515100       1.114300    
 H   -2.688100       1.013300       1.431700    
 H   -4.415600      0.7701000       1.110500    
 H    2.329000       4.824600     -0.2724000    
 H    2.747300       3.144000     -0.6149000    
 H   0.8439000      -1.906000      0.5558000    
 H    1.079100      -2.431600      -1.124000    
 H    1.492300      0.4246000     -6.6600002E-02
 H    1.753700     -6.4099997E-02  -1.720100    
 H    3.722200       2.915900       1.678500    
 H    3.301700       4.605700       2.022200    
 H    4.491800       4.225000      0.7654000    
 H   -4.363700       1.668100      -1.621700    
 H  -0.6626000      -3.733300      0.1003000    
 H   -4.968600      -1.389800      0.8597000    
 H   -2.505300      -4.875000       1.245500    
 H   -4.659900      -3.707700       1.628900    
 H    3.026300     -0.2689000       1.727900    
 H    3.649200      -1.497300      -2.353600    
 H    5.339200     -0.9464000       2.279100    
 H    5.960700      -2.171000      -1.792500    
 H    6.810000      -1.898000      0.5223000    


%chk=000134992-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000134992

0 1
O -1.468953 0.295350 0.450719
O -2.011214 1.350737 -2.018569
O 0.051720 -0.613047 -1.605824
N -1.670240 4.039205 0.609215
C -2.340501 2.112403 -0.823054
C -1.218938 3.117409 -0.458882
C -0.597156 4.833314 1.252552
C -1.159533 5.720277 2.380402
C -2.662856 1.175156 0.355485
C -0.073207 6.578217 3.067510
C 1.480476 -2.500998 -1.094064
C -1.588843 -1.021981 0.849583
C 2.470582 -1.903861 -2.124620
C -0.647071 -1.957871 0.301432
C 0.264464 -1.598896 -0.833214
C -0.633317 7.452061 4.210353
C 3.613179 -2.866390 -2.414304
C -2.542361 -1.439019 1.812872
C -0.659935 -3.286558 0.813923
C -1.595559 -3.699202 1.781442
C -2.547076 -2.771579 2.269638
C 4.787759 -2.863752 -1.617760
C 3.513094 -3.816978 -3.463409
C 5.831814 -3.785491 -1.858314
C 4.553793 -4.741292 -3.708569
C 5.717433 -4.730164 -2.904706
H -3.261120 2.676200 -1.074838
H -0.907648 3.628984 -1.398600
H -0.342621 2.554868 -0.085036
H 0.140371 4.122793 1.676002
H -0.038958 5.475761 0.524592
H -1.659993 5.071889 3.126187
H -1.944156 6.390212 1.966982
H -2.425105 4.656094 0.272552
H -2.782376 1.753872 1.289679
H -3.553957 0.557758 0.137067
H 0.416182 7.225749 2.311470
H 0.719356 5.912076 3.465954
H 1.997821 -2.714791 -0.138834
H 1.120024 -3.481986 -1.468048
H 2.857168 -0.945226 -1.732185
H 1.914124 -1.659303 -3.046324
H -1.097448 6.826741 4.996147
H -1.407707 8.147931 3.835517
H 0.162030 8.055976 4.684648
H -1.279527 0.695058 -1.804014
H 0.054691 -4.017730 0.424227
H -3.252116 -0.712619 2.220986
H -1.592208 -4.731373 2.145158
H -3.283942 -3.083020 3.018337
H 4.887658 -2.127995 -0.809392
H 2.617449 -3.825054 -4.097648
H 6.733814 -3.763941 -1.235850
H 4.460720 -5.463770 -4.527629
H 6.527119 -5.443504 -3.095542


