%chk=000003148.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000003148

0 1
 O  -0.3353000      0.8821000     -0.2054000    
 O    6.738200     -0.8412000     -7.6600000E-02
 O   -1.049000      -1.304700     -0.2916000    
 N    3.623200      0.5574000       1.043800    
 N   -4.218100       1.938800      0.1200000    
 C    2.889700     -0.7311000      0.9383000    
 C    3.410500       1.340500     -0.2018000    
 C    4.506700     -0.7866000     -0.9951000    
 C    3.421500      -1.571900     -0.2506000    
 C    3.962300      0.5774000      -1.433300    
 C    1.380300     -0.4587000      0.8433000    
 C    1.921200       1.692600     -0.3405000    
 C    1.019000      0.4600000     -0.3236000    
 C    5.067800      0.3001000       1.236000    
 C    5.570000     -0.4846000      3.9999999E-02
 C   -1.270000     -0.1070000     -0.2029000    
 C   -2.635600      0.4620000     -7.6399997E-02
 C   -3.831100     -0.2525000     -4.1499998E-02
 C   -2.861000       1.788300      2.0700000E-02
 C   -4.836000      0.7090000      8.4700003E-02
 C   -4.196800      -1.611900     -0.1014000    
 C   -6.193900      0.3776000      0.1542000    
 C   -5.551100      -1.958300     -3.3100002E-02
 C   -6.532700     -0.9772000      9.2799999E-02
 H    3.047900      -1.300900       1.864000    
 H    3.950000       2.293200     -0.1148000    
 H    4.927800      -1.352300      -1.830500    
 H    2.620800      -1.854900     -0.9427000    
 H    3.851700      -2.503900      0.1386000    
 H    4.775400       1.165000      -1.879200    
 H    3.200800      0.4467000      -2.209800    
 H   0.8803000      -1.429100      0.7927000    
 H    1.034700     -1.8000000E-03   1.781400    
 H    1.628400       2.365300      0.4777000    
 H    1.745800       2.264200      -1.260700    
 H    1.126600     -7.2499998E-02  -1.276300    
 H    5.236000     -0.2801000       2.149000    
 H    5.618800       1.243100       1.310500    
 H   -2.216600       2.656500      3.1700000E-02
 H   -4.697900       2.824100      0.2067000    
 H   -3.449900      -2.394100     -0.1993000    
 H   -6.958800       1.140700      0.2522000    
 H   -5.839200      -3.005200     -7.8800000E-02
 H   -7.578700      -1.268700      0.1441000    


%chk=000003148-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000003148

0 1
O -0.335268 0.870391 0.058836
O 6.906387 -0.852208 -0.279267
O -1.086217 -1.264321 -0.559091
N 3.790371 0.704293 0.952578
N -4.357021 1.920365 0.515292
C 3.061923 -0.602116 1.120131
C 3.427421 1.309703 -0.376619
C 4.524192 -0.929491 -0.954527
C 3.492376 -1.621393 -0.006912
C 3.867630 0.354469 -1.554587
C 1.541231 -0.326952 1.164419
C 1.918781 1.650800 -0.379473
C 1.072910 0.400477 -0.109410
C 5.258252 0.471400 1.012019
C 5.715194 -0.489912 -0.105527
C -1.343074 -0.085283 -0.192208
C -2.676647 0.470274 0.022591
C -3.941422 -0.236463 -0.129242
C -2.979277 1.781800 0.417729
C -4.982593 0.700882 0.187678
C -4.289485 -1.561212 -0.496732
C -6.351166 0.360351 0.148746
C -5.654358 -1.909163 -0.536935
C -6.672667 -0.962579 -0.219166
H 3.362835 -1.001857 2.106442
H 3.989759 2.259257 -0.450051
H 4.862399 -1.615450 -1.748897
H 2.623677 -1.951239 -0.607103
H 3.936135 -2.530380 0.438135
H 4.579114 0.865776 -2.228250
H 3.003034 0.049767 -2.174396
H 0.988222 -1.275516 1.283680
H 1.326602 0.318640 2.036157
H 1.724194 2.390578 0.418584
H 1.633447 2.104668 -1.346393
H 1.080582 -0.294813 -0.969695
H 5.534164 0.048140 1.996962
H 5.798665 1.432630 0.914390
H -2.295773 2.600760 0.627952
H -4.842752 2.773918 0.784535
H -3.504248 -2.282514 -0.739399
H -7.135775 1.085087 0.392486
H -5.944200 -2.927698 -0.817730
H -7.723855 -1.268466 -0.261234


