%chk=000041232.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041232

0 1
 O   -2.226000      0.4418000      3.0000001E-04
 O    2.237000       1.246700     -9.9999997E-05
 O   -1.064400      -1.528200     -1.9999999E-04
 N   6.6999998E-03  0.5533000      1.9999999E-04
 C    1.380200      0.2194000      9.9999997E-05
 C   -3.453800     -0.2958000     -3.0000001E-04
 C    1.977900     -0.9857000      1.9999999E-04
 C   -4.613500      0.6772000     -1.9999999E-04
 C   -1.076900     -0.3034000      3.9999999E-04
 C    3.363600     -0.6983000     -1.9999999E-04
 C    3.469100      0.6731000     -1.9999999E-04
 H   -3.499900     -0.9266000     -0.8950000    
 H   -3.500400     -0.9273000      0.8939000    
 H  -0.1852000       1.551500      9.9999997E-05
 H    1.520700      -1.964200      3.9999999E-04
 H   -5.569500      0.1462000     -6.9999998E-04
 H   -4.570600       1.327700      0.8795000    
 H   -4.570100       1.328400     -0.8794000    
 H    4.183100      -1.402400     -3.0000001E-04
 H    4.303900       1.358800     -3.9999999E-04


%chk=000041232-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000041232

0 1
O -2.251670 0.486691 -0.000971
O 2.260917 1.261647 0.000053
O -1.002974 -1.521977 -0.000709
N 0.007643 0.612154 -0.001116
C 1.342653 0.201844 -0.000452
C -3.507517 -0.311302 -0.000241
C 1.995414 -1.022614 -0.000160
C -4.662410 0.685797 0.000414
C -1.066750 -0.267276 -0.001546
C 3.414462 -0.711790 0.000555
C 3.549869 0.662917 0.000645
H -3.512272 -0.961550 -0.894816
H -3.511265 -0.961560 0.894330
H -0.193561 1.613969 -0.001189
H 1.515003 -1.995903 -0.000440
H -5.623440 0.139226 0.000937
H -4.627902 1.329120 0.896498
H -4.628897 1.329151 -0.895686
H 4.229941 -1.432817 0.000937
H 4.384657 1.356474 0.001056


