%chk=000011364.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000011364

0 1
 O    1.854000       1.657700      0.3313000    
 N    1.061300     -0.5135000     -0.1453000    
 C  -0.3031000     -0.2308000     -7.3799998E-02
 C  -0.7664000       1.051100     -0.3696000    
 C   -1.204000      -1.230700      0.2924000    
 C    1.483400      -1.925100     -0.4039000    
 C    2.082800      0.4666000      0.1061000    
 C   -2.130700       1.333300     -0.2989000    
 C   -2.568200     -0.9487000      0.3629000    
 C   -3.031500      0.3333000      6.7199998E-02
 C    3.522400      6.8000001E-03  0.1316000    
 H  -0.1228000       1.848400     -0.7239000    
 H  -0.8831000      -2.235100      0.5534000    
 H    2.449200      -1.959600     -0.9119000    
 H   0.7629000      -2.424100      -1.059600    
 H    1.562700      -2.445000      0.5554000    
 H   -2.494000       2.327200     -0.5436000    
 H   -3.269800      -1.725700      0.6525000    
 H   -4.094000      0.5523000      0.1198000    
 H    3.854100     -0.2344000     -0.8815000    
 H    3.641400     -0.8562000      0.7914000    
 H    4.155000      0.8130000      0.5166000    


%chk=000011364-Freq.chk
%nprocshared=24
%mem=100GB
#p freq=noraman PBEPBE/SDD

000011364

0 1
O 1.860996 1.678356 0.370497
N 1.117456 -0.497508 -0.130735
C -0.292949 -0.189890 -0.057125
C -0.801660 1.098517 -0.379851
C -1.205734 -1.214214 0.317382
C 1.483150 -1.909684 -0.386470
C 2.119972 0.461618 0.129393
C -2.190548 1.339850 -0.328690
C -2.593003 -0.959468 0.362217
C -3.097051 0.319383 0.038712
C 3.571145 -0.026114 0.112962
H -0.113611 1.899449 -0.648614
H -0.841700 -2.208131 0.595501
H 2.463306 -1.968330 -0.880074
H 0.739850 -2.361753 -1.062895
H 1.525122 -2.509191 0.544123
H -2.563940 2.338084 -0.583397
H -3.276591 -1.763310 0.657671
H -4.173553 0.517534 0.073727
H 3.901234 -0.291334 -0.909173
H 3.737820 -0.901800 0.764579
H 4.191890 0.808737 0.468860


