%chk=000004832.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004832

1 1
 O    1.009400     -0.2796000     -0.4093000    
 O  -0.7019000     -0.4546000       1.628900    
 O  -0.4716000      -1.809100      -1.278200    
 N    4.036000     -0.3257000      0.3271000    
 C    3.339000     -4.5100000E-02  -1.015500    
 C    4.195800      -1.829500      0.5660000    
 C    2.048300     -0.8396000      -1.204900    
 C    2.868200      -2.564600      0.4489000    
 C    2.215700      -2.324800     -0.9055000    
 C    5.441600      0.2937000      0.2610000    
 C    3.313400      0.3440000       1.496000    
 C    5.319800       1.778500     -2.7999999E-03
 C  -0.2258000     -0.8636000     -0.5388000    
 C   -1.256900     -0.1439000      0.3345000    
 C   -2.674700     -0.7086000      0.2169000    
 C   -1.254000       1.371800      0.1239000    
 C   -3.354900     -0.5391000     -0.9670000    
 C   -1.416700       2.189200       1.218700    
 C   -3.214400      -1.363500       1.299600    
 C   -1.089100       1.859300      -1.152100    
 C   -4.647100      -1.053200      -1.074000    
 C   -1.414500       3.570900       1.026800    
 C   -4.506600      -1.877800       1.192600    
 C   -1.086800       3.240800      -1.344000    
 C   -5.222900      -1.722600      5.7000001E-03
 C   -1.249500       4.096700     -0.2546000    
 H    4.052800     -0.3093000      -1.804600    
 H    3.104300       1.022500      -1.062900    
 H    4.634500      -1.962300       1.561500    
 H    4.903500      -2.203900     -0.1835000    
 H    1.747400     -0.7202000      -2.254400    
 H    2.181900      -2.285500       1.254700    
 H    3.052600      -3.639000      0.5696000    
 H    2.877700      -2.746100      -1.675000    
 H    1.313800      -2.933300     -0.9484000    
 H    5.944200      9.3999997E-02   1.214200    
 H    5.994900     -0.2046000     -0.5432000    
 H    2.428400     -0.2389000       1.753600    
 H    3.984000      0.3717000       2.360100    
 H    2.989200       1.347100       1.208600    
 H    6.330700       2.205600      2.4000001E-03
 H    4.914500       2.018500     -0.9889000    
 H    4.769000       2.329400      0.7623000    
 H   9.7300000E-02  8.3499998E-02   1.763300    
 H   -2.925100     -4.5499999E-02  -1.830400    
 H   -1.561500       1.801300       2.221900    
 H   -2.689400      -1.502200       2.238200    
 H  -0.9571000       1.215600      -2.015600    
 H   -5.203000     -0.9375000      -1.999900    
 H   -1.544600       4.237300       1.874400    
 H   -4.955600      -2.399100       2.033000    
 H  -0.9575000       3.650500      -2.341600    
 H   -6.228500      -2.124200     -7.8100003E-02
 H   -1.248300       5.172400     -0.4043000    


%chk=000004832-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000004832

1 1
O 1.279238 0.240859 -0.535731
O -0.033431 1.579421 1.212435
O -0.222419 0.616008 -2.270041
N 3.868523 -1.011385 0.422066
C 3.584787 -0.336066 -0.938963
C 3.366059 -2.481473 0.397672
C 2.155378 -0.530906 -1.458757
C 1.909003 -2.623702 -0.063723
C 1.707820 -2.002789 -1.461316
C 5.406502 -1.068720 0.654273
C 3.208787 -0.245157 1.573826
C 6.128619 0.282443 0.678951
C 0.053200 0.692705 -1.058102
C -0.892379 1.142108 0.082346
C -1.650309 -0.158177 0.460977
C -1.807428 2.298664 -0.336100
C -2.536967 -0.756386 -0.471437
C -3.101142 2.417526 0.233585
C -1.445890 -0.765923 1.721710
C -1.327896 3.330611 -1.183868
C -3.218894 -1.945933 -0.136774
C -3.902169 3.546911 -0.043563
C -2.136034 -1.954636 2.056547
C -2.131490 4.455301 -1.464357
C -3.021819 -2.548815 1.128760
C -3.421012 4.567877 -0.894010
H 4.295685 -0.776209 -1.660675
H 3.802412 0.736448 -0.821913
H 3.520761 -2.877836 1.415718
H 4.039271 -3.018890 -0.295394
H 2.080774 -0.091659 -2.471585
H 1.209580 -2.171887 0.661292
H 1.679555 -3.704256 -0.088786
H 2.295579 -2.554386 -2.221712
H 0.650586 -2.061297 -1.769042
H 5.539669 -1.602048 1.612149
H 5.809193 -1.706674 -0.152343
H 2.126749 -0.178047 1.406749
H 3.448819 -0.768534 2.512819
H 3.611962 0.777054 1.595365
H 7.203948 0.081436 0.830460
H 6.038837 0.835528 -0.270310
H 5.806251 0.933150 1.507831
H -0.475587 2.364631 1.625806
H -2.698810 -0.287957 -1.449162
H -3.486835 1.625170 0.883968
H -0.768382 -0.286979 2.435207
H -0.334271 3.254050 -1.638600
H -3.909996 -2.396480 -0.857083
H -4.900497 3.626494 0.399097
H -1.991590 -2.408197 3.043469
H -1.756743 5.240827 -2.128844
H -3.560182 -3.466055 1.390550
H -4.045470 5.440041 -1.114539


