%chk=000145340.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000145340

0 1
 O  -0.5524000      -1.179800      -1.898500    
 N   -1.661400     -0.7475000      9.3599997E-02
 C    1.635400       2.436600     -0.1696000    
 C    2.260800       1.202500      0.4965000    
 C   0.1539000       2.289500     -0.5498000    
 C    2.384100     -4.4999998E-03 -0.4404000    
 C  -0.7578000       2.075600      0.6608000    
 C    2.502200      -1.336600      0.3066000    
 C   -2.203600       1.712400      0.3055000    
 C    1.203700      -1.847700      0.9561000    
 C   -2.380400      0.4023000     -0.4759000    
 C   0.1887000      -2.436600     -3.0099999E-02
 C  -0.7103000      -1.404600     -0.6932000    
 C   -2.062900      -1.161400       1.438500    
 H    1.740600       3.290600      0.5109000    
 H    2.207900       2.684700      -1.071700    
 H    1.709500      0.9474000       1.404700    
 H    3.269200       1.471300      0.8374000    
 H  -0.1640000       3.202600      -1.068500    
 H   4.1900001E-02   1.479600      -1.273800    
 H    3.288900      0.1331000      -1.046500    
 H    1.561700     -5.1399998E-02  -1.152600    
 H  -0.3586000       1.298300       1.316000    
 H  -0.7677000       2.996000       1.258100    
 H    3.266400      -1.233900       1.087500    
 H    2.875800      -2.099100     -0.3879000    
 H   -2.773500       1.645400       1.240700    
 H   -2.656600       2.529400     -0.2691000    
 H   0.7527000      -1.067100       1.574800    
 H    1.490500      -2.655500       1.642000    
 H   -3.444100      0.1377000     -0.5103000    
 H   -2.073000      0.5640000      -1.514200    
 H  -0.4393000      -3.182900      0.4667000    
 H   0.7131000      -2.988600     -0.8203000    
 H   -1.630500      -2.115100       1.736900    
 H   -3.152500      -1.259900       1.462600    
 H   -1.754100     -0.3995000       2.158200    


%chk=000145340-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000145340

0 1
O -0.495374 -1.016981 -1.880978
N -1.648051 -0.707852 0.116612
C 1.627358 2.437897 -0.131988
C 2.229548 1.167427 0.527033
C 0.141474 2.292106 -0.560684
C 2.423552 -0.020086 -0.452230
C -0.824801 2.142264 0.638913
C 2.567907 -1.395312 0.252394
C -2.278177 1.755291 0.273069
C 1.293589 -1.954527 0.943703
C -2.419608 0.406970 -0.485829
C 0.170574 -2.452552 -0.021078
C -0.683369 -1.351637 -0.663270
C -2.030675 -1.089456 1.482877
H 1.718600 3.292174 0.571420
H 2.234796 2.699679 -1.022798
H 1.580817 0.855709 1.369873
H 3.207581 1.422831 0.984150
H -0.153772 3.182334 -1.153499
H 0.041920 1.424039 -1.238374
H 3.337666 0.163609 -1.053106
H 1.591814 -0.067511 -1.176381
H -0.424560 1.378302 1.333889
H -0.844644 3.094031 1.209306
H 3.368118 -1.319485 1.018908
H 2.916528 -2.144816 -0.487382
H -2.887628 1.734055 1.199806
H -2.727707 2.536867 -0.372611
H 0.883891 -1.202209 1.646426
H 1.599998 -2.819076 1.566446
H -3.492175 0.122633 -0.523508
H -2.061471 0.498497 -1.523673
H -0.472340 -3.178245 0.513665
H 0.633796 -2.996584 -0.862622
H -1.460144 -1.961856 1.829266
H -3.109672 -1.341013 1.520214
H -1.851061 -0.260219 2.193742


