%chk=000148519.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148519

0 1
 O    2.137100     -0.2601000      0.2997000    
 O    4.835000      -1.003300      0.4179000    
 O   -2.285000      -2.436700     -2.5100000E-02
 O   -3.747300     -0.8037000     -0.1444000    
 N   -2.567300      -1.216000     -5.2900001E-02
 N   -3.092500       1.596000     -0.1073000    
 C   0.8554000      0.1872000      0.2001000    
 C   -1.511300     -0.2650000      2.2299999E-02
 C   -1.771100       1.105300     -4.1999999E-03
 C  -0.1981000     -0.7241000      0.1245000    
 C   0.5954000       1.557500      0.1735000    
 C    3.157500      0.5624000     -0.2641000    
 C  -0.7178000       2.016500      7.1400002E-02
 C    4.310100     -0.3158000     -0.7113000    
 H   4.0700000E-02  -1.784900      0.1477000    
 H    1.383300       2.300000      0.2575000    
 H    2.799600       1.111100      -1.144000    
 H    3.497300       1.267000      0.5035000    
 H  -0.9066000       3.087000      5.7700001E-02
 H    5.109200      0.2740000      -1.169600    
 H    3.969600      -1.071900      -1.425100    
 H   -3.247400       2.596000     -0.1236000    
 H   -3.889400      0.9805000     -0.1641000    
 H    5.157700     -0.3337000       1.044900    


%chk=000148519-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000148519

0 1
O 2.105203 -0.363746 -0.360327
O 4.825772 -1.100307 0.659739
O -2.290163 -2.508556 0.017352
O -3.866560 -0.872783 0.199500
N -2.615728 -1.259825 0.074010
N -3.156274 1.653442 0.184867
C 0.825491 0.198119 -0.220786
C -1.569437 -0.246479 -0.003296
C -1.875812 1.162422 0.055291
C -0.237647 -0.711065 -0.137749
C 0.554001 1.598275 -0.165060
C 3.251223 0.550098 -0.407370
C -0.761945 2.056061 -0.029925
C 4.524348 -0.290962 -0.520331
H -0.049424 -1.786328 -0.175500
H 1.362589 2.332561 -0.228933
H 3.171329 1.215041 -1.294821
H 3.273452 1.183804 0.507274
H -0.955415 3.134174 0.011238
H 5.366336 0.394483 -0.765330
H 4.413571 -1.020917 -1.338369
H -3.319456 2.656643 0.220592
H -3.921309 0.971705 0.240262
H 4.859956 -0.520562 1.462671


