%chk=000028934.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028934

0 1
 O   -1.498200       1.191300       1.116100    
 O   -2.679500       1.498700     -0.8312000    
 O    2.751900       1.787000      -1.027200    
 O    4.170000      0.1087000      0.6747000    
 N   -3.466300      -1.115700     -0.7286000    
 C   -2.198700     -0.7686000     -6.0100000E-02
 C   -1.049400      -1.274100     -0.9650000    
 C   0.3488000     -0.9008000     -0.5272000    
 C   -2.214500      -1.437100       1.321900    
 C   -2.184600      0.7631000      1.6200000E-02
 C   0.9075000      0.2813000     -0.9832000    
 C    1.041900      -1.748600      0.3203000    
 C    2.197300      0.6259000     -0.5797000    
 C    2.331900      -1.404000      0.7237000    
 C    2.909600     -0.2168000      0.2737000    
 C   -1.367800       2.609700       1.255600    
 H   -1.186000     -0.8938000      -1.988700    
 H   -1.105800      -2.367900      -1.064700    
 H   -1.315000      -1.207000       1.902100    
 H   -3.069000      -1.092100       1.917000    
 H   -2.282500      -2.528000       1.237900    
 H   -3.539700      -2.128400     -0.8232000    
 H   -3.472500     -0.7452000      -1.678700    
 H   0.3579000      0.9399000      -1.650300    
 H   0.6019000      -2.676200      0.6745000    
 H    2.881600      -2.064900       1.388300    
 H  -0.7954000       2.810100       2.165100    
 H   -2.354400       3.072700       1.351600    
 H  -0.8256000       3.026100      0.4012000    
 H    3.719300       1.731300     -0.9692000    
 H    4.302900       1.066600      0.5908000    


%chk=000028934-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000028934

0 1
O -1.963911 1.333317 1.243206
O -1.955012 1.510330 -1.070232
O 3.128257 1.655803 -0.814599
O 4.425354 -0.149689 0.722300
N -3.459212 -0.978218 -0.659718
C -2.122621 -0.740565 -0.065422
C -0.966597 -1.301604 -0.989065
C 0.455990 -1.006612 -0.539939
C -2.085344 -1.380032 1.333641
C -1.998473 0.799337 -0.034544
C 1.089253 0.208859 -0.920129
C 1.184018 -1.923695 0.261002
C 2.399244 0.483672 -0.494525
C 2.502820 -1.645364 0.687410
C 3.117737 -0.436583 0.313424
C -1.903797 2.814782 1.320874
H -1.140210 -0.881487 -1.998060
H -1.128557 -2.395256 -1.049465
H -1.124184 -1.185362 1.834008
H -2.896505 -0.979313 1.961684
H -2.213010 -2.476183 1.241256
H -3.823161 -1.923934 -0.518715
H -3.565938 -0.629416 -1.617115
H 0.546400 0.926601 -1.549315
H 0.718495 -2.873125 0.549760
H 3.068124 -2.353754 1.300063
H -1.898627 3.036828 2.396862
H -2.783335 3.256003 0.823296
H -0.985925 3.183723 0.833276
H 2.611136 2.259163 -1.399770
H 4.685193 0.734973 0.352250


