%chk=000006464.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006464

0 1
 O  -0.6839000      -1.441900       1.664800    
 O   8.4200002E-02   1.060800      -2.233500    
 O    3.580700     -0.7628000      0.1131000    
 N    1.451700      -1.018400      0.9421000    
 N    1.835500      0.2323000      -1.004800    
 C  -0.3885000      0.3220000      2.7200000E-02
 C  -0.3609000       1.614400      0.8627000    
 C   -1.827200      4.6100002E-02 -0.4334000    
 C   8.0799997E-02 -0.8084000      0.9377000    
 C   0.5001000      0.5578000      -1.190000    
 C  -0.7856000       2.803800      9.6000005E-03
 C   -1.260300       1.472700       2.084800    
 C   -1.918700      -1.275100      -1.121700    
 C    2.375600     -0.5187000      3.2200001E-02
 C   -2.683400      -2.284600     -0.6910000    
 H   0.6592000       1.808700       1.221600    
 H   -2.188100      0.7930000      -1.149100    
 H   -2.542900      4.0700000E-02  0.3934000    
 H   -1.793700       2.714900     -0.4027000    
 H  -0.7977000       3.706300      0.6342000    
 H  -8.3899997E-02   3.024800     -0.7987000    
 H   -2.324900       1.398600       1.850900    
 H   -1.165700       2.382100       2.693300    
 H  -0.9764000      0.6572000       2.752700    
 H    1.809200      -1.668700       1.636400    
 H    2.475900      0.5039000      -1.745600    
 H   -1.350500      -1.417900      -2.037100    
 H   -2.717700      -3.219100      -1.240400    
 H   -3.283900      -2.202600      0.2081000    


%chk=000006464-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000006464

0 1
O -0.630194 -1.416625 1.864998
O -0.024096 0.908282 -2.273893
O 3.603316 -0.810785 0.053070
N 1.467489 -1.017582 0.986715
N 1.776254 0.177505 -1.024724
C -0.471213 0.282527 0.073293
C -0.381745 1.671332 0.901215
C -1.936392 -0.061448 -0.335539
C 0.073421 -0.799965 1.025448
C 0.402854 0.463225 -1.178055
C -0.634674 2.916387 0.018222
C -1.339884 1.678063 2.116830
C -2.042715 -1.265794 -1.255624
C 2.374006 -0.558383 0.014915
C -2.527160 -2.474963 -0.875109
H 0.659514 1.731354 1.282872
H -2.363665 0.823814 -0.840254
H -2.507714 -0.251135 0.587837
H -1.638642 2.892574 -0.441455
H -0.579428 3.818901 0.654763
H 0.102808 3.030794 -0.793426
H -2.392080 1.776622 1.795840
H -1.106005 2.550994 2.753800
H -1.251504 0.768724 2.734363
H 1.858544 -1.644259 1.697867
H 2.392372 0.418380 -1.808376
H -1.708489 -1.114078 -2.291590
H -2.592925 -3.312279 -1.579745
H -2.863050 -2.660281 0.152541


