%chk=000019601.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019601

0 1
 O   -1.311800     -7.6300003E-02  3.1999999E-03
 O   -2.697700       1.761600     -5.4000001E-03
 N    2.275600      0.7314000     -5.5999998E-03
 C    3.480200     -0.1052000     -4.0000002E-03
 C    4.709900      0.8092000     -1.0300000E-02
 C    3.473100     -0.9682000       1.262200    
 C    3.481200     -0.9980000      -1.250300    
 C    1.080100     -9.4400004E-02  1.0400000E-02
 C  -0.1700000      0.7707000      4.4999998E-03
 C   -2.524400      0.5511000     -1.9000000E-03
 C   -3.619000     -0.4591000     -1.3000000E-03
 C   -3.297900      -1.922200      3.1999999E-03
 C   -4.879300     -6.9999998E-04 -4.9000001E-03
 H    2.269000       1.330500     -0.8310000    
 H    4.722100       1.467000      0.8668000    
 H    5.637500      0.2257000      2.3000001E-03
 H    4.731900       1.443900     -0.9039000    
 H    2.758900      -1.797500       1.224700    
 H    3.269200     -0.3720000       2.159700    
 H    4.457300      -1.431000       1.408200    
 H    3.290800     -0.4214000      -2.163300    
 H    4.463400      -1.471200      -1.374200    
 H    2.759100      -1.819700      -1.201800    
 H    1.008800     -0.7246000      0.9026000    
 H    1.004000     -0.7560000     -0.8585000    
 H  -0.1898000       1.404100     -0.8910000    
 H  -0.1927000       1.410600      0.8953000    
 H   -2.716000      -2.190800     -0.8847000    
 H   -2.719900      -2.186200      0.8950000    
 H   -4.202500      -2.539800      2.7999999E-03
 H   -5.720700     -0.6867000     -4.6999999E-03
 H   -5.117700       1.057600     -8.2000000E-03


%chk=000019601-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000019601

0 1
O -1.403310 -0.163184 0.035711
O -2.684352 1.772765 0.240575
N 2.247676 0.562806 -0.123354
C 3.567623 -0.142423 -0.029736
C 4.650559 0.961124 -0.112861
C 3.673723 -0.856827 1.341181
C 3.779007 -1.172182 -1.180259
C 1.011850 -0.246706 -0.163267
C -0.175023 0.676042 0.131926
C -2.620879 0.524620 0.110457
C -3.783957 -0.420452 0.013123
C -3.513669 -1.903106 -0.138173
C -5.031424 0.122750 0.068588
H 2.265279 1.251780 -0.889603
H 4.519522 1.688710 0.707356
H 5.662066 0.523263 -0.041510
H 4.587150 1.508391 -1.074122
H 2.970033 -1.705575 1.422780
H 3.455471 -0.144008 2.155353
H 4.693173 -1.259277 1.483259
H 3.746639 -0.671611 -2.166846
H 4.758666 -1.676225 -1.084138
H 2.996344 -1.952980 -1.164003
H 1.063105 -1.021253 0.621437
H 0.830580 -0.771451 -1.130351
H -0.254420 1.506513 -0.595086
H -0.106460 1.109255 1.144483
H -2.919653 -2.106758 -1.047140
H -2.922877 -2.286529 0.712996
H -4.459187 -2.468396 -0.197352
H -5.929182 -0.501438 0.004468
H -5.161374 1.204765 0.180009


