%chk=000037554.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000037554

0 1
 O  -0.3343000      -2.480200      0.2074000    
 O   -3.529500       3.004700      0.3026000    
 O   -1.643700       2.325000     -0.7691000    
 O    6.146200     -0.2077000     -0.4178000    
 O    5.503000       1.720100      0.4124000    
 N   -1.098000     -0.2721000     -9.2000002E-03
 N   -2.983000      -1.675600      0.1311000    
 N    5.248900      0.5603000      6.3000000E-03
 C    1.264200     -0.7960000      6.6900000E-02
 C   -2.506300     -0.4233000      7.7000000E-03
 C  -0.1124000      -1.264500      8.7200001E-02
 C    2.278300      -1.631900     -0.4003000    
 C    1.570300      0.4894000      0.5141000    
 C   -3.280600      0.7122000     -0.1032000    
 C    3.904900      0.1029000      2.6799999E-02
 C    3.598700      -1.182500     -0.4201000    
 C    2.890600      0.9388000      0.4941000    
 C   -4.661400      0.5492000     -8.5800000E-02
 C   -5.204000     -0.7249000      3.9900001E-02
 C   -4.329700      -1.794700      0.1442000    
 C   -2.722200       2.050800     -0.2353000    
 H  -0.7806000      0.6810000     -0.1478000    
 H    2.060300      -2.634900     -0.7580000    
 H   0.8224000       1.161700      0.9240000    
 H    4.362600      -1.860600     -0.7920000    
 H    3.093800       1.942800      0.8582000    
 H   -5.339900       1.392600     -0.1806000    
 H   -6.277200     -0.8764000      5.2900001E-02
 H   -4.702300      -2.808800      0.2430000    
 H   -3.146200       3.902700      0.2086000    


%chk=000037554-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000037554

0 1
O -0.316161 -2.546179 -0.187639
O -3.700461 3.075420 0.314367
O -1.517874 2.320431 0.238614
O 6.306404 -0.364499 -0.034773
O 5.623230 1.808907 0.075687
N -1.137267 -0.330972 0.001135
N -3.072116 -1.723410 -0.130053
N 5.387989 0.540954 0.011917
C 1.287398 -0.737522 -0.054478
C -2.528813 -0.477779 -0.014031
C -0.123770 -1.306929 -0.088317
C 2.339838 -1.689965 -0.101762
C 1.606603 0.646931 0.014711
C -3.352322 0.710287 0.094712
C 3.970396 0.095902 -0.011127
C 3.685254 -1.285359 -0.080455
C 2.949965 1.068962 0.036515
C -4.762066 0.545314 0.077224
C -5.315859 -0.740839 -0.042858
C -4.424955 -1.838252 -0.143147
C -2.760692 2.053961 0.217206
H -0.850723 0.658610 0.095185
H 2.066269 -2.748047 -0.157243
H 0.834430 1.422746 0.050161
H 4.506502 -2.005468 -0.116154
H 3.217872 2.127206 0.088810
H -5.395101 1.432705 0.157918
H -6.397219 -0.898520 -0.059738
H -4.804589 -2.862305 -0.239005
H -3.229262 3.947811 0.394818


