%chk=000011877.chk
%nprocshared=24
%mem=100GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000011877

0 1
 O   0.3202000      -2.846700      2.4999999E-03
 O    1.861700      -1.283800      7.9999998E-04
 N    1.318100       1.144200     -5.0000002E-04
 N   0.6604000      -1.640500      1.4000000E-03
 C  -2.8600000E-02  0.7155000     -7.9999998E-04
 C  -0.3529000     -0.6411000      3.9999999E-04
 C   -1.041400       1.674700     -1.8000000E-03
 C    2.014100       1.366600       1.249500    
 C    2.019400       1.352000      -1.250200    
 C   -1.689900      -1.038600      6.9999998E-04
 C   -2.378400       1.277100     -1.5000000E-03
 C   -2.702700     -7.9400003E-02 -3.9999999E-04
 H  -0.8015000       2.735000     -2.6000000E-03
 H    3.101100       1.325600       1.122800    
 H    1.742600      0.6183000       2.002300    
 H    1.759700       2.354600       1.647500    
 H    1.709300      0.6301000      -2.014000    
 H    3.103400       1.254900      -1.128400    
 H    1.811600       2.357300      -1.631200    
 H   -1.984600      -2.084900      1.6000000E-03
 H   -3.167000       2.023900     -2.2000000E-03
 H   -3.744000     -0.3884000     -1.9999999E-04


%chk=000011877-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000011877

0 1
O 0.219061 -2.704751 -1.350832
O 1.723545 -1.757891 0.081298
N 1.344169 1.153265 0.058923
N 0.589432 -1.745769 -0.556165
C 0.052666 0.651100 0.167295
C -0.357030 -0.653775 -0.294985
C -0.991986 1.482514 0.700655
C 1.754753 2.329694 0.843683
C 2.300105 0.697295 -0.961927
C -1.728894 -1.015214 -0.371641
C -2.336661 1.091187 0.671878
C -2.724071 -0.151908 0.102905
H -0.738977 2.473317 1.086826
H 2.853830 2.330738 0.929837
H 1.340565 2.284364 1.864976
H 1.443457 3.286305 0.373195
H 1.766085 0.239293 -1.812329
H 3.006960 -0.054875 -0.564995
H 2.858647 1.572431 -1.341067
H -1.970267 -2.005901 -0.766450
H -3.097880 1.770412 1.071812
H -3.776907 -0.445432 0.062808


