%chk=000082591.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000082591

0 1
 O    1.865900      0.5148000      0.2335000    
 O    3.176900      -1.176900     -0.6363000    
 N   -1.759000     -1.7700000E-02 -0.1688000    
 C  -0.5223000      0.6473000      0.2402000    
 C   -2.919700      0.7973000      0.1880000    
 C   -1.855200      -1.341100      0.4461000    
 C   0.6896000     -0.1754000     -0.1673000    
 C   -2.812500       2.167600     -0.4530000    
 C   -3.109100      -2.048700     -3.0700000E-02
 C    3.049300     -0.1024000     -6.4900003E-02
 C    4.196200      0.7352000      0.4133000    
 H  -0.4974000      0.8371000       1.321800    
 H  -0.3966000       1.620300     -0.2470000    
 H   -3.842200      0.3572000     -0.2038000    
 H   -3.033900      0.9023000       1.274200    
 H   -1.037600      -1.992700      0.1274000    
 H   -1.841200      -1.293500       1.541900    
 H   0.7058000     -0.3260000      -1.253700    
 H   0.7210000      -1.145000      0.3362000    
 H   -2.103600       2.821400      6.4499997E-02
 H   -2.539800       2.106900      -1.512500    
 H   -3.785300       2.670600     -0.4001000    
 H   -4.016500      -1.662100      0.4436000    
 H   -3.223000      -1.993200      -1.119000    
 H   -3.053100      -3.110900      0.2344000    
 H    4.136900      0.8603000       1.497300    
 H    4.180100       1.706100     -8.8100001E-02
 H    5.137600      0.2335000      0.1714000    


%chk=000082591-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000082591

0 1
O 1.923973 0.509767 0.317722
O 3.102886 -0.794892 -1.212191
N -1.785808 -0.013393 0.182139
C -0.478951 0.505034 0.656202
C -2.901302 0.957503 0.333069
C -2.100415 -1.363933 0.723929
C 0.642552 -0.000358 -0.259085
C -2.843578 2.100053 -0.698991
C -3.036631 -2.177096 -0.190171
C 3.098887 0.031095 -0.271025
C 4.318589 0.664112 0.364874
H -0.258966 0.213069 1.709985
H -0.487336 1.608664 0.627370
H -3.847106 0.404299 0.190624
H -2.936576 1.383052 1.368264
H -1.147339 -1.915481 0.829256
H -2.538010 -1.296623 1.752481
H 0.526779 0.387312 -1.285835
H 0.686198 -1.103071 -0.307785
H -1.919892 2.698972 -0.599450
H -2.872811 1.687910 -1.722588
H -3.701497 2.785517 -0.566408
H -4.019299 -1.687473 -0.315969
H -2.584040 -2.292125 -1.190261
H -3.216444 -3.181318 0.237158
H 4.087441 1.060366 1.364753
H 4.668302 1.498183 -0.270798
H 5.131696 -0.076846 0.421332


