%chk=000018709.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000018709

0 1
 O   -1.400200      -1.050800     -0.5960000    
 O    2.373300       1.794100     -0.1556000    
 O    4.007100     -0.5213000      0.3744000    
 N   -4.535800      0.5653000      0.4657000    
 C   -3.632300     -0.5111000      8.7499999E-02
 C   -2.254900      3.7500001E-02 -0.2488000    
 C    1.868600      0.5204000     -0.1231000    
 C    2.658300     -0.6004000      0.1446000    
 C  -7.1300000E-02 -0.8999000     -0.3423000    
 C    3.664700       1.871400      0.4541000    
 C    4.545400      0.7385000     -3.6400001E-02
 C   0.5060000      0.3696000     -0.3818000    
 C    2.077700      -1.867900      0.1970000    
 C   0.7124000      -2.016300     -4.7800001E-02
 C   -5.851300      3.3500001E-02  0.8305000    
 C   -4.667700       1.537600     -0.6220000    
 H   -4.016800      -1.089800     -0.7634000    
 H   -3.526600      -1.226000      0.9142000    
 H   -1.877500      0.5826000      0.6269000    
 H   -2.280500      0.7030000      -1.117000    
 H    3.540100       1.843800       1.543700    
 H    4.102800       2.837400      0.1845000    
 H    4.635600      0.7411000      -1.129700    
 H    5.549700      0.8261000      0.3896000    
 H  -7.0100002E-02   1.257100     -0.6277000    
 H    2.682400      -2.743700      0.4165000    
 H   0.2650000      -3.006100     -1.4000000E-02
 H   -5.762900     -0.6730000       1.663400    
 H   -6.336300     -0.4796000     -7.8999996E-03
 H   -6.511400      0.8384000       1.172700    
 H   -5.460400       2.260300     -0.3924000    
 H   -4.917400       1.064600      -1.578800    
 H   -3.763500       2.142300     -0.7409000    


%chk=000018709-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000018709

0 1
O -1.417077 -1.097051 0.006323
O 2.509069 1.825428 0.285839
O 4.203800 -0.548332 -0.043111
N -4.724343 0.626962 0.191361
C -3.738334 -0.476570 0.116223
C -2.304192 0.070099 0.140204
C 1.966258 0.525395 0.137904
C 2.785688 -0.622943 -0.010983
C -0.030984 -0.866048 0.013187
C 3.951547 1.814515 0.613257
C 4.690220 0.823546 -0.292667
C 0.559553 0.411866 0.143831
C 2.182320 -1.892737 -0.130203
C 0.782449 -2.022110 -0.114973
C -5.996696 0.223180 0.823117
C -4.945234 1.297607 -1.106750
H -3.871735 -1.113963 -0.791695
H -3.869667 -1.133756 0.994356
H -2.114707 0.595112 1.096911
H -2.120684 0.775165 -0.696163
H 4.081950 1.533205 1.676379
H 4.297116 2.848637 0.454080
H 4.528518 1.084312 -1.357267
H 5.769734 0.801058 -0.072697
H -0.028311 1.325511 0.263216
H 2.828381 -2.768946 -0.241294
H 0.301705 -2.999605 -0.207940
H -5.802215 -0.185433 1.830318
H -6.562341 -0.546265 0.238479
H -6.648830 1.108307 0.935026
H -5.592855 2.180677 -0.961505
H -5.430108 0.631788 -1.865684
H -3.987797 1.650089 -1.527379


