%chk=000002278.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002278

0 1
 O   -1.045500      0.8047000     -0.7226000    
 O    4.057800     -0.8181000      0.4001000    
 O   -3.746400     -0.1127000       2.242000    
 O   -1.128700     -7.1500003E-02   1.436300    
 O    5.670000      -1.595200     -0.9022000    
 O    5.478100      -2.423200       1.159100    
 N    5.163700      -1.693400      0.2162000    
 C    2.602300      0.8603000     -0.4486000    
 C   0.2498000       1.249500     -0.4450000    
 C    1.309300      0.4159000     -0.7253000    
 C    3.771400     -1.7999999E-02 -0.7405000    
 C    2.801800       2.126900      0.1009000    
 C   0.4155000       2.504300      9.7199999E-02
 C   -2.995900     -0.3023000     -2.8700000E-02
 C    1.708500       2.948900      0.3738000    
 C   -1.653000      0.1296000      0.3330000    
 C   -3.997800     -0.4091000      0.9358000    
 C   -3.273700     -0.6111000      -1.360200    
 C   -5.277700     -0.8249000      0.5687000    
 C   -4.553700      -1.026900      -1.727300    
 C   -5.555700      -1.133800     -0.7629000    
 H    1.140200     -0.5685000      -1.152000    
 H    3.537000     -0.6514000      -1.606700    
 H    4.635700      0.6088000     -0.9988000    
 H    3.803900       2.484100      0.3231000    
 H  -0.4354000       3.144000      0.3090000    
 H    1.863600       3.934800      0.8021000    
 H   -2.512200     -0.5527000      -2.133400    
 H   -6.068000     -0.9131000       1.309400    
 H   -4.769500      -1.270800      -2.763400    
 H   -6.552000      -1.458400      -1.048800    
 H   -4.558700     -0.2453000       2.760200    


%chk=000002278-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000002278

0 1
O -0.919175 0.414213 0.000733
O 4.321473 -0.892683 -0.374156
O -4.922223 1.445682 1.098191
O -2.227480 1.821073 1.366102
O 5.800186 -1.231839 -2.211295
O 5.879182 -2.605816 -0.373582
N 5.444706 -1.646117 -1.061669
C 2.711429 0.883599 -0.399253
C 0.350561 1.004706 0.241950
C 1.383308 0.420442 -0.525307
C 3.811845 0.254665 -1.216069
C 2.999372 1.938126 0.504517
C 0.624797 2.062205 1.144469
C -3.251118 -0.040934 0.132982
C 1.959577 2.514381 1.262319
C -2.149575 0.847152 0.591316
C -4.619055 0.270143 0.413367
C -2.970873 -1.239048 -0.584517
C -5.650392 -0.604725 -0.015765
C -3.994105 -2.106149 -1.006434
C -5.342310 -1.784331 -0.718207
H 1.133046 -0.395197 -1.211655
H 3.453811 -0.153805 -2.176768
H 4.650579 0.947333 -1.402305
H 4.028098 2.299851 0.612033
H -0.176315 2.516883 1.726379
H 2.179501 3.331274 1.957638
H -1.925746 -1.472943 -0.797385
H -6.696275 -0.353554 0.204671
H -3.748091 -3.022512 -1.551172
H -6.151020 -2.449326 -1.039745
H -5.903017 1.538651 1.209115


