%chk=000066869.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000066869

0 1
 O   -4.718000     -0.9696000      0.2044000    
 N   0.3923000       1.215100      1.3100000E-02
 N    5.506600      -1.087300     -0.1259000    
 C  -0.9019000      0.6613000      6.1500002E-02
 C    1.678000      0.6366000     -2.2500001E-02
 C   -1.975000       1.341500     -0.5164000    
 C   -1.113900     -0.5681000      0.6876000    
 C    2.762300       1.311700      0.5380000    
 C    1.865400     -0.6109000     -0.6177000    
 C   -3.467300     -0.4351000      0.1577000    
 C    4.221200     -0.5081000     -9.1700003E-02
 C   -3.256900      0.7936000     -0.4683000    
 C   -2.395900      -1.115900      0.7355000    
 C    4.033900      0.7394000      0.5034000    
 C    3.136900      -1.183300     -0.6523000    
 C   -5.767700     -0.2208000     -0.4064000    
 H   0.4019000       2.231200      9.9999997E-05
 H   -1.822700       2.299300      -1.007800    
 H  -0.3026000      -1.110200       1.165500    
 H    2.628700       2.283900       1.005700    
 H    1.043600      -1.149400      -1.081700    
 H   -4.043300       1.375000     -0.9372000    
 H   -2.554700      -2.071000       1.228600    
 H    4.870700       1.275300      0.9441000    
 H    3.271100      -2.154000      -1.123000    
 H    6.293400     -0.5977000      0.2792000    
 H    5.643200      -1.991200     -0.5583000    
 H   -5.609400     -0.1118000      -1.484700    
 H   -5.916000      0.7437000      9.0999998E-02
 H   -6.691700     -0.7933000     -0.2754000    


%chk=000066869-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000066869

0 1
O -4.767474 -1.023007 0.167294
N 0.417509 1.272622 -0.074997
N 5.592172 -1.108544 -0.011945
C -0.865557 0.682700 -0.040663
C 1.686194 0.632712 -0.040115
C -1.982758 1.433100 -0.497635
C -1.103538 -0.623058 0.482583
C 2.801388 1.338088 0.488898
C 1.911220 -0.667809 -0.568526
C -3.510069 -0.390202 0.070077
C 4.313737 -0.535026 -0.023409
C -3.294567 0.913926 -0.436562
C -2.405633 -1.149150 0.529206
C 4.092113 0.775777 0.486156
C 3.196080 -1.243188 -0.549868
C -5.928608 -0.266344 -0.295475
H 0.435913 2.290886 -0.139611
H -1.823706 2.437295 -0.911060
H -0.272411 -1.212047 0.880109
H 2.652555 2.339291 0.913015
H 1.083831 -1.222123 -1.021874
H -4.125875 1.528699 -0.794971
H -2.590458 -2.149000 0.934655
H 4.932733 1.349718 0.895550
H 3.338434 -2.249187 -0.964336
H 6.386787 -0.601585 0.364602
H 5.745793 -2.043548 -0.375821
H -5.848138 -0.017135 -1.372581
H -6.064572 0.666601 0.287603
H -6.790893 -0.930561 -0.134199


