%chk=000077582.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077582

0 1
 O  -1.8200001E-02   2.151900      -1.127300    
 N   -3.632400      0.9334000      0.3928000    
 C   0.6684000      -1.731800      -1.037900    
 C  -0.5072000      -2.025800     -0.1153000    
 C    1.635400     -0.7948000     -0.3762000    
 C   -1.525100     -0.9230000      4.7699999E-02
 C    1.289900      0.5338000     -0.1173000    
 C   -1.302800      0.4460000     -0.1485000    
 C  -1.5200000E-02   1.086700     -0.5149000    
 C    2.911300      -1.245300     -4.6999999E-03
 C   -2.811900      -1.328600      0.4467000    
 C    2.210300       1.405600      0.4803000    
 C   -2.387400       1.312600      2.8300000E-02
 C    3.823700     -0.3818000      0.6033000    
 C    3.473700      0.9438000      0.8441000    
 C   -3.812300     -0.3827000      0.5990000    
 H   0.3383000      -1.317700      -1.998700    
 H    1.175100      -2.676300      -1.273200    
 H  -0.1497000      -2.315200      0.8817000    
 H   -1.022400      -2.901000     -0.5348000    
 H    3.205900      -2.275800     -0.1880000    
 H   -3.035900      -2.376100      0.6289000    
 H    1.952300       2.443900      0.6737000    
 H   -2.286400       2.386300     -0.1062000    
 H    4.808000     -0.7439000      0.8855000    
 H    4.184500       1.617500       1.313200    
 H   -4.813000     -0.6748000      0.8986000    


%chk=000077582-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000077582

0 1
O -0.122970 2.284412 0.969617
N -3.710034 0.924618 -0.420125
C 0.582015 -1.897828 -0.501534
C -0.573972 -1.988188 0.527192
C 1.618315 -0.822068 -0.201892
C -1.647182 -0.960543 0.238530
C 1.317359 0.490788 0.286545
C -1.363833 0.433227 0.170502
C -0.052734 1.096596 0.509815
C 2.979917 -1.170064 -0.407164
C -2.980526 -1.370942 -0.011603
C 2.397878 1.382161 0.565970
C -2.433282 1.317379 -0.163777
C 4.033075 -0.272216 -0.141226
C 3.737390 1.017320 0.358986
C -3.968895 -0.416042 -0.326910
H 0.148104 -1.741529 -1.510546
H 1.102003 -2.872458 -0.538985
H -0.164328 -1.860369 1.548158
H -1.022309 -2.997047 0.484077
H 3.213159 -2.175950 -0.776579
H -3.245455 -2.432427 0.042294
H 2.137662 2.376055 0.942725
H -2.231709 2.391553 -0.218768
H 5.071214 -0.578314 -0.312022
H 4.541966 1.726155 0.580698
H -5.005927 -0.717380 -0.513177


