%chk=000092409.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000092409

0 1
 O   -7.250500       1.273200     -0.2841000    
 O   -5.953200       1.751500       1.528000    
 N   -2.584300      0.3409000     -0.6409000    
 C   -5.034300      0.4971000     -0.3217000    
 C   -3.662100       1.084200      2.7500000E-02
 C   -5.102400     -0.9901000      2.0400001E-02
 C   -3.930500      -1.733900     -0.6104000    
 C   -2.596900      -1.076400     -0.2528000    
 C   -1.285000      0.9421000     -0.3407000    
 C  -0.1813000      0.2379000      -1.128700    
 C   -6.096900       1.241700      0.4268000    
 C    1.165300      0.8500000     -0.8377000    
 C    2.255200      0.2521000     -0.3075000    
 C    3.500500       1.023200     -9.3599997E-02
 C    2.151700      -1.190700      3.5100002E-02
 C    4.437200       1.083100      -1.108100    
 C    1.734600      -1.547100       1.300200    
 C    3.692500       1.664700       1.115400    
 C    2.474800      -2.126100     -0.9254000    
 C    5.609300       1.811700     -0.9062000    
 C    1.635900      -2.901200       1.619800    
 C    4.864800       2.393300       1.317300    
 C    2.376000      -3.480300     -0.6058000    
 C    5.823200       2.466900      0.3065000    
 C    1.956500      -3.867900      0.6667000    
 H   -5.201200      0.6393000      -1.398300    
 H   -3.640400       2.134400     -0.2922000    
 H   -3.505500       1.081700       1.115300    
 H   -6.048500      -1.420100     -0.3294000    
 H   -5.081200      -1.130000       1.109200    
 H   -3.932400      -2.776700     -0.2730000    
 H   -4.053300      -1.750700      -1.701000    
 H   -2.400900      -1.193600      0.8210000    
 H   -1.853100      -1.666500     -0.7920000    
 H   -1.069200      0.8982000      0.7355000    
 H   -1.297500       2.002800     -0.6241000    
 H  -0.3731000      0.3411000      -2.204600    
 H  -0.1385000     -0.8301000     -0.9258000    
 H    1.240600       1.905300      -1.103100    
 H   -7.960400       1.755800      0.1907000    
 H    4.281800      0.5782000      -2.057600    
 H    1.479900     -0.8030000       2.049600    
 H    2.953000       1.616200       1.910000    
 H    2.801100      -1.836200      -1.920200    
 H    6.355500       1.869200      -1.693300    
 H    1.308300      -3.203100       2.610400    
 H    5.031200       2.903800       2.261400    
 H    2.625200      -4.233000      -1.348100    
 H    6.735800       3.034200      0.4637000    
 H    1.879100      -4.922300      0.9152000    


%chk=000092409-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000092409

0 1
O -7.475981 1.348917 -0.856829
O -6.221552 2.678045 0.570985
N -2.751488 0.232283 -0.329717
C -5.180478 0.696451 -0.505971
C -3.826301 1.179836 0.053883
C -5.515845 -0.727010 0.033892
C -4.345242 -1.683890 -0.279350
C -3.006734 -1.117204 0.235911
C -1.404004 0.759298 0.004663
C -0.268187 0.029954 -0.757621
C -6.286033 1.681587 -0.184260
C 1.064977 0.709917 -0.534856
C 2.272098 0.133763 -0.223564
C 3.459425 1.001750 0.071415
C 2.469736 -1.351232 -0.170021
C 4.767131 0.605359 -0.326889
C 3.144393 -1.949914 0.930812
C 3.315606 2.247894 0.744879
C 2.007002 -2.198647 -1.214074
C 5.883589 1.434375 -0.085318
C 3.327146 -3.347682 0.997344
C 4.431006 3.077772 0.986740
C 2.196577 -3.597087 -1.153646
C 5.722103 2.677400 0.569774
C 2.852667 -4.179296 -0.044814
H -5.101171 0.623797 -1.608833
H -3.585470 2.176152 -0.358046
H -3.912580 1.295659 1.164103
H -6.456448 -1.088397 -0.417034
H -5.670119 -0.670227 1.130688
H -4.530400 -2.671531 0.184312
H -4.271256 -1.834456 -1.373406
H -3.027072 -1.080573 1.358080
H -2.182862 -1.791036 -0.055831
H -1.199055 0.713650 1.104967
H -1.385702 1.829486 -0.280408
H -0.541915 0.044879 -1.833358
H -0.211519 -1.030167 -0.455738
H 1.040452 1.807599 -0.620150
H -8.178486 2.013093 -0.618026
H 4.903214 -0.352872 -0.840220
H 3.519679 -1.311494 1.738545
H 2.326049 2.551547 1.105159
H 1.524361 -1.752020 -2.090553
H 6.879162 1.111939 -0.411029
H 3.840375 -3.788174 1.859673
H 4.296010 4.029614 1.513167
H 1.840077 -4.229480 -1.974686
H 6.589314 3.319229 0.761219
H 3.000154 -5.264055 0.003433


