%chk=000006881.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006881

0 1
 O   0.8699000      0.5974000     -0.1263000    
 O    2.403900       2.264000      0.2844000    
 N    4.849200       1.513700     -0.6947000    
 C    3.121600     -4.1999999E-03  0.1260000    
 C    4.423300      0.2363000     -0.2670000    
 C   -3.812800      0.2160000      0.1684000    
 C    2.703100      -1.252900      0.5452000    
 C  -0.1811000       1.552600     -0.1674000    
 C    2.117900       1.089800      0.1089000    
 C    5.343300     -0.8118000     -0.2403000    
 C   -2.538200      0.8801000      0.3924000    
 C   -1.467900      0.8396000     -0.4336000    
 C    3.623000      -2.301000      0.5721000    
 C    4.943100      -2.080400      0.1792000    
 C   -3.894900     -0.8536000     -0.7230000    
 C   -4.953100      0.6492000      0.8449000    
 C   -5.117300      -1.490200     -0.9379000    
 C   -6.175500      1.2600000E-02  0.6300000    
 C   -6.257600      -1.057200     -0.2613000    
 H    1.686600      -1.451800      0.8718000    
 H   4.0000002E-03   2.266300     -0.9787000    
 H  -0.2182000       2.098400      0.7827000    
 H    6.375300     -0.6539000     -0.5434000    
 H   -2.463600       1.466100       1.306300    
 H   -1.504000      0.2932000      -1.371700    
 H    3.312800      -3.288100      0.9023000    
 H    5.659500      -2.896400      0.2011000    
 H   -3.030400      -1.238200      -1.256300    
 H   -4.909000       1.482200       1.542600    
 H   -5.180900      -2.326300      -1.628300    
 H   -7.063500      0.3497000       1.156700    
 H   -7.209100      -1.553600     -0.4277000    
 H    4.201500       2.288000     -0.7390000    
 H    5.810300       1.652400     -0.9783000    


%chk=000006881-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000006881

0 1
O 0.869669 0.541683 0.062334
O 2.380945 2.177148 -0.625695
N 4.977480 1.513909 -0.701037
C 3.194240 -0.040254 -0.005217
C 4.583705 0.267916 -0.257141
C -3.920757 0.228512 0.120357
C 2.837037 -1.341496 0.454066
C -0.234210 1.539709 -0.134842
C 2.165682 0.989112 -0.221911
C 5.555814 -0.759473 -0.034021
C -2.621773 0.894821 0.339722
C -1.491855 0.775080 -0.414355
C 3.804818 -2.333783 0.665946
C 5.172320 -2.029706 0.416624
C -4.171124 -0.656817 -0.967860
C -4.979306 0.475656 1.039803
C -5.429459 -1.270964 -1.122946
C -6.240441 -0.138047 0.885117
C -6.472035 -1.015798 -0.198336
H 1.778606 -1.544728 0.639126
H 0.062289 2.201927 -0.970440
H -0.312644 2.148642 0.784119
H 6.613166 -0.536458 -0.222110
H -2.581040 1.561113 1.215642
H -1.458347 0.115144 -1.290953
H 3.513602 -3.327760 1.018629
H 5.939665 -2.795817 0.578369
H -3.379741 -0.866478 -1.696061
H -4.805023 1.154734 1.884013
H -5.602597 -1.949471 -1.965960
H -7.039384 0.067123 1.606318
H -7.449556 -1.494397 -0.323405
H 4.251371 2.225096 -0.847878
H 5.960085 1.712122 -0.869916


