%chk=000011494.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000011494

0 1
 O    3.059300      -1.117400     -6.9999998E-04
 O   -3.229700       1.044800     -2.9000000E-03
 N   -1.732100     -0.7760000      6.9999998E-04
 C  -0.4749000     -0.1706000      1.1000000E-03
 C   0.6778000     -0.9561000      6.0000003E-04
 C    1.934300     -0.3507000       0.000000    
 C  -0.3709000       1.220400      1.2000001E-03
 C    2.038300       1.040200       0.000000    
 C   0.8857000       1.825900      7.9999998E-04
 C   -2.989700     -0.1583000      3.0000001E-04
 C   -4.109000      -1.169000     -9.9999997E-05
 C    4.311000     -0.4331000     -1.3000000E-03
 H   0.6054000      -2.041300      3.9999999E-04
 H   -1.216400       1.894100      2.0000001E-03
 H    2.981600       1.575500     -3.0000001E-04
 H   -1.723800      -1.794000      7.9999998E-04
 H   0.9669000       2.909200      1.0000000E-03
 H   -4.056400      -1.777800     -0.9070000    
 H   -5.073500     -0.6543000      2.7400000E-02
 H   -4.026800      -1.814400      0.8790000    
 H    4.444700      0.1624000      0.9082000    
 H    4.443600      0.1626000     -0.9108000    
 H    5.096500      -1.196000     -1.8000000E-03


%chk=000011494-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000011494

0 1
O 3.028873 -1.139533 0.000410
O -3.294555 1.029370 0.003472
N -1.746919 -0.740545 0.002381
C -0.497793 -0.053943 0.001318
C 0.672073 -0.851458 0.001389
C 1.946738 -0.242816 0.000291
C -0.393964 1.365233 0.000185
C 2.069322 1.168894 -0.000840
C 0.888736 1.945936 -0.000861
C -3.040703 -0.210041 0.001880
C -4.137841 -1.276918 -0.001042
C 4.377109 -0.568695 -0.000750
H 0.620982 -1.946585 0.002222
H -1.300033 1.971445 0.000263
H 3.047710 1.656288 -0.001671
H -1.681179 -1.761415 0.002888
H 0.972731 3.038692 -0.001701
H -4.089356 -1.898022 -0.914796
H -5.114325 -0.772946 0.031069
H -4.053354 -1.945701 0.875579
H 4.556121 0.046878 0.902576
H 4.555159 0.045477 -0.905220
H 5.056371 -1.433494 -0.000443


