%chk=000006731.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006731

0 1
 O   -1.259500      0.9863000       2.373800    
 O   -1.262600      0.9920000      -2.372000    
 N   0.9589000     -0.2152000     -8.9999998E-04
 C  -0.8109000       1.436800      1.4000000E-03
 C   -1.528500      0.8335000       1.197100    
 C   -1.529700      0.8368000      -1.195200    
 C   -2.632800      1.2000000E-02  0.6964000    
 C   -2.633400      1.4000000E-02 -0.6958000    
 C   0.6432000       1.100300      3.0000001E-04
 C    1.573800       2.119500      1.6000000E-03
 C   -3.568600     -0.6993000       1.421600    
 C   -3.570100     -0.6951000      -1.422100    
 C    2.261200     -0.5573000     -1.0000000E-03
 C    3.285600      0.4125000      1.9999999E-04
 C    2.914700       1.763800      1.6000000E-03
 C   -4.526000      -1.420800      0.7034000    
 C   -4.526900      -1.418800     -0.7050000    
 C    2.630200      -1.899700     -2.4000001E-03
 C    4.634700      1.9500000E-02  3.0000001E-04
 C    3.971500      -2.290600     -2.3000001E-03
 C    4.975200      -1.330200     -8.9999998E-04
 H   -1.003200       2.516300      3.0000000E-03
 H    1.284800       3.164700      2.7999999E-03
 H   -3.569000     -0.7052000       2.505500    
 H   -3.571700     -0.6977000      -2.506100    
 H    3.669500       2.546800      2.7000001E-03
 H   -5.280300      -1.993400       1.236900    
 H   -5.281700      -1.989600      -1.239500    
 H    1.862600      -2.671400     -3.4000000E-03
 H    5.428300      0.7634000      1.3000000E-03
 H    4.228100      -3.346000     -3.4000000E-03
 H    6.018600      -1.629900     -7.9999998E-04


%chk=000006731-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000006731

0 1
O -1.368233 1.228265 2.430544
O -1.370319 1.236242 -2.426979
N 0.915274 -0.139582 0.000409
C -0.842390 1.548151 0.002082
C -1.596083 0.954524 1.227197
C -1.596462 0.957762 -1.224396
C -2.642262 0.025230 0.709232
C -2.642808 0.027471 -0.708553
C 0.634326 1.181020 0.001336
C 1.645215 2.198145 0.001635
C -3.552940 -0.768286 1.437865
C -3.554234 -0.763551 -1.438972
C 2.246538 -0.529079 -0.000254
C 3.333376 0.430557 0.000024
C 2.987612 1.820599 0.000993
C -4.463702 -1.567030 0.710455
C -4.464367 -1.564657 -0.713376
C 2.549855 -1.928180 -0.001209
C 4.685312 -0.042104 -0.000664
C 3.878306 -2.360369 -0.001870
C 4.953167 -1.412955 -0.001594
H -0.944214 2.649350 0.003617
H 1.352790 3.252355 0.002373
H -3.541800 -0.758735 2.532223
H -3.543928 -0.750575 -2.533304
H 3.782168 2.575640 0.001216
H -5.182125 -2.198597 1.244440
H -5.183242 -2.194490 -1.248797
H 1.711364 -2.631192 -0.001398
H 5.505732 0.685720 -0.000448
H 4.105874 -3.431978 -0.002611
H 5.988200 -1.771669 -0.002116


