%chk=000027563.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027563

0 1
 O    1.810100       2.113100      0.2858000    
 N  -0.2860000      -2.017400     -0.2707000    
 N   -3.710500      0.8013000      0.1952000    
 C  -0.6291000      0.1823000     -0.1860000    
 C   -1.245600      -1.043600     -0.3533000    
 C   -1.327500       1.500900     -0.2135000    
 C   -2.681800      -1.356100     -0.5878000    
 C   0.7666000     -7.0400000E-02  5.5000000E-03
 C   -2.557700       1.559000      0.6976000    
 C   -3.602300     -0.6470000      0.4091000    
 C   0.9487000      -1.453800     -5.1100001E-02
 C    1.896800      0.7465000      0.2217000    
 C    2.200900      -2.060900      9.8999999E-02
 C    3.155600      0.1539000      0.3738000    
 C    3.303000      -1.229400      0.3134000    
 C    1.958700       2.821500     -0.9387000    
 H  -0.6521000       2.297300      0.1104000    
 H   -1.609900       1.738800      -1.247000    
 H   -2.951800      -1.081600      -1.615200    
 H   -2.844900      -2.437800     -0.5011000    
 H   -2.309600       1.260800       1.724000    
 H   -2.870400       2.609200      0.7510000    
 H   -4.607900      -1.063700      0.2723000    
 H   -3.317300     -0.8692000       1.445200    
 H  -0.4576000      -3.009700     -0.3579000    
 H   -4.538100       1.127700      0.6961000    
 H    2.316300      -3.138600      5.0999999E-02
 H    4.032100      0.7752000      0.5414000    
 H    4.289300      -1.670100      0.4339000    
 H    1.254700       2.457100      -1.693600    
 H    2.984100       2.726300      -1.309600    
 H    1.752600       3.878900     -0.7515000    


%chk=000027563-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000027563

0 1
O 1.510216 2.163829 -0.385339
N -0.348789 -2.119939 -0.113933
N -3.876641 0.672476 0.209442
C -0.786629 0.115184 -0.302586
C -1.369956 -1.155988 -0.224738
C -1.543156 1.418460 -0.454357
C -2.820309 -1.561817 -0.276443
C 0.652254 -0.081660 -0.234877
C -2.743120 1.582544 0.508860
C -3.735736 -0.728608 0.656674
C 0.899909 -1.494567 -0.116321
C 1.785234 0.785995 -0.264445
C 2.195364 -2.055092 -0.023416
C 3.085993 0.245412 -0.175464
C 3.280823 -1.162191 -0.055133
C 2.652731 3.075763 -0.438358
H -0.839116 2.251740 -0.289931
H -1.932582 1.520308 -1.488048
H -3.212793 -1.452353 -1.307245
H -2.916872 -2.631612 0.000854
H -2.376715 1.455824 1.557882
H -3.123462 2.617747 0.412010
H -4.743612 -1.186254 0.647869
H -3.338359 -0.803781 1.699695
H -0.505320 -3.121638 -0.024693
H -4.771274 1.073806 0.512347
H 2.351851 -3.135266 0.066209
H 3.964090 0.897232 -0.196782
H 4.303823 -1.548838 0.012216
H 3.302986 2.856384 -1.307880
H 3.252751 3.027414 0.491532
H 2.215817 4.079988 -0.546198


