%chk=000066315.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000066315

0 1
 O   -3.424400       1.097700     -0.5655000    
 O    2.888000       1.970400     -0.7669000    
 O   0.3959000      -3.898100      3.7500001E-02
 N  -8.0000004E-03 -0.2331000     -2.8800000E-02
 C   -1.394400     -0.1884000     -0.4728000    
 C   0.7734000      0.8295000     -0.6652000    
 C   0.5857000      -1.540400     -0.3180000    
 C   -2.060800       1.150600     -0.1472000    
 C    2.209700      0.8830000     -0.1388000    
 C  -0.2038000      -2.649800      0.3584000    
 C   -2.047500       1.478500       1.340400    
 C    2.286200       1.100200       1.367100    
 H   -1.485000     -0.3881000      -1.549400    
 H   -2.014500     -0.9382000      2.7600000E-02
 H   0.7842000      0.7195000      -1.758500    
 H   0.3578000       1.823000     -0.4707000    
 H    1.607900      -1.622500      6.4700000E-02
 H   0.6438000      -1.731700      -1.398000    
 H   -1.621200       1.972800     -0.7183000    
 H    2.780700     -1.0300000E-02 -0.4072000    
 H   -1.232300      -2.732500      3.7000000E-03
 H  -0.2046000      -2.531900       1.447200    
 H   -1.032300       1.604400       1.726800    
 H   -2.547700      0.6931000       1.918000    
 H   -2.600000       2.404900       1.533200    
 H    1.856600      0.2643000       1.926500    
 H    1.766800       2.020700       1.656400    
 H    3.329200       1.221000       1.680200    
 H   -3.823500       1.966200     -0.3861000    
 H    2.865700       1.815400      -1.726700    
 H  -0.1124000      -4.587400      0.4982000    


%chk=000066315-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000066315

0 1
O -3.223968 1.623928 -0.518056
O 3.292063 1.689185 -0.770318
O 0.253438 -3.874005 0.301740
N 0.019351 -0.217839 -0.450081
C -1.376206 0.140076 -0.800654
C 1.036306 0.700888 -1.006185
C 0.338569 -1.655441 -0.622108
C -1.964839 1.210143 0.141626
C 2.263791 0.882411 -0.076744
C -0.084578 -2.473450 0.606017
C -2.213515 0.688039 1.564462
C 1.935363 1.637450 1.210773
H -1.464782 0.519137 -1.844277
H -2.012159 -0.761994 -0.733806
H 1.395771 0.356339 -2.011136
H 0.581377 1.696885 -1.160053
H 1.429230 -1.775624 -0.751142
H -0.142252 -2.093522 -1.526608
H -1.267574 2.075681 0.183559
H 2.680875 -0.118899 0.172220
H -1.174358 -2.357707 0.788972
H 0.463347 -2.105550 1.498568
H -1.277377 0.269207 1.974750
H -2.983798 -0.105410 1.552072
H -2.554571 1.495216 2.240798
H 1.118855 1.122447 1.745439
H 1.618264 2.668706 0.971397
H 2.821821 1.692837 1.865227
H -3.712094 2.241681 0.082788
H 3.529518 1.242811 -1.623823
H -0.006667 -4.450825 1.062380


