%chk=000087135.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000087135

0 1
 O    2.900400     -0.4576000      0.3546000    
 O   -3.210000       1.166100     -0.2181000    
 N    1.768900       2.108900      0.1299000    
 N   -3.419900      -1.114200     -9.5299996E-02
 C   0.9676000      0.9463000      0.1304000    
 C   -1.220600     -7.1999997E-02  1.8800000E-02
 C    1.549300     -0.3165000      0.2432000    
 C  -0.4175000       1.068500      1.8200001E-02
 C  -0.6389000      -1.334700      0.1315000    
 C   0.7460000      -1.456900      0.2438000    
 C   -2.664600      5.4900002E-02 -9.9699996E-02
 C    3.639400     -0.5927000     -0.8574000    
 H  -0.8603000       2.058200     -6.8899997E-02
 H   -1.199300      -2.261700      0.1387000    
 H    1.193200      -2.443600      0.3322000    
 H    1.339600       3.020900      4.8799999E-02
 H    2.772500       2.029300      0.2249000    
 H    3.486700      0.2753000      -1.506300    
 H    3.348100      -1.508400      -1.381700    
 H    4.701400     -0.6576000     -0.6053000    
 H   -3.059100      -2.055300     -8.2999999E-03
 H   -4.429500      -1.052900     -0.1837000    


%chk=000087135-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000087135

0 1
O 2.973000 0.132780 -0.253249
O -3.374820 1.139920 0.038577
N 1.609925 2.357395 0.307264
N -3.442722 -1.170628 0.099373
C 0.873147 1.199576 0.090653
C -1.250880 -0.045736 -0.070689
C 1.572123 -0.015987 -0.213360
C -0.537822 1.158090 0.153221
C -0.541942 -1.233068 -0.379599
C 0.871120 -1.212835 -0.450764
C -2.750735 0.031648 0.021404
C 3.770275 -1.052193 -0.568782
H -1.117498 2.062368 0.369858
H -1.062701 -2.168551 -0.610741
H 1.410459 -2.131722 -0.700191
H 1.148078 3.237200 0.512991
H 2.623166 2.318397 0.242505
H 3.522428 -1.443619 -1.574439
H 3.620076 -1.847300 0.187076
H 4.816844 -0.714135 -0.549316
H -2.978706 -2.070842 0.190464
H -4.459414 -1.126460 0.148042


