%chk=000088387.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088387

0 1
 O   -1.276000      4.6999999E-03 -0.1331000    
 O   -3.156600      0.9878000      0.7816000    
 N    3.027300     -0.6007000      0.2885000    
 C    1.009700      0.8753000     -7.8299999E-02
 C    1.611000     -0.3961000      0.5802000    
 C  -0.4685000       1.083200      0.3217000    
 C    1.100000      0.7952000      -1.613900    
 C    1.841300       2.086900      0.3930000    
 C    3.232500     -0.7944000      -1.147100    
 C    3.545000      -1.746700       1.036400    
 C   -2.604000      8.8600002E-02  0.1681000    
 C   -3.272700      -1.110100     -0.3787000    
 C   -4.588900      -1.273700     -0.2186000    
 H    1.026500      -1.277600      0.2814000    
 H    1.482600     -0.3011000       1.667500    
 H  -0.5468000       1.150400       1.414500    
 H  -0.8488000       2.021400     -0.1030000    
 H    2.006100       1.218700      -2.047600    
 H   0.8593000     -0.1933000      -2.013600    
 H   0.3240000       1.447600      -2.042400    
 H    2.885900       2.035200      6.8400003E-02
 H    1.427600       3.019200     -9.3000000E-03
 H    1.831700       2.169700       1.485900    
 H    2.472200      -1.407600      -1.638900    
 H    4.164500      -1.359300      -1.301100    
 H    3.469800      0.1346000      -1.661800    
 H    3.407000      -1.599100       2.113500    
 H    4.623300      -1.858900      0.8769000    
 H    3.052300      -2.683400      0.7511000    
 H   -2.681700      -1.849000     -0.9082000    
 H   -5.079200      -2.154200     -0.6205000    
 H   -5.206500     -0.5529000      0.3058000    


%chk=000088387-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000088387

0 1
O -1.303308 0.017372 -0.198590
O -3.159918 0.785943 0.995844
N 2.944128 -0.729914 -0.132508
C 0.989794 0.909809 -0.017277
C 1.535196 -0.525544 0.288742
C -0.453845 1.021016 0.509936
C 1.043150 1.188631 -1.538422
C 1.838608 1.966779 0.734047
C 3.118599 -1.718739 -1.213301
C 3.891972 -0.934251 0.978784
C -2.659786 0.010129 0.143830
C -3.375526 -1.030235 -0.641587
C -4.709202 -1.234475 -0.487200
H 0.875412 -1.259406 -0.215747
H 1.434893 -0.711686 1.380928
H -0.513952 0.814145 1.596138
H -0.879061 2.025322 0.325665
H 2.082876 1.072027 -1.891331
H 0.392932 0.490869 -2.095691
H 0.711987 2.220187 -1.763333
H 2.890760 1.875810 0.412642
H 1.494509 2.993298 0.506575
H 1.793990 1.825536 1.831877
H 2.900195 -2.770730 -0.896903
H 4.160663 -1.686995 -1.582301
H 2.453586 -1.473501 -2.059078
H 3.792890 -0.119055 1.716167
H 4.928384 -0.915613 0.593450
H 3.745889 -1.905374 1.517651
H -2.770516 -1.613418 -1.343652
H -5.243199 -1.997856 -1.062440
H -5.282198 -0.629681 0.225483


