%chk=000070064.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000070064

0 1
 O    2.003700      0.1396000      1.7000000E-03
 N    3.173500       2.075200     -1.2000001E-03
 C  -0.2728000      0.8162000      8.9999998E-04
 C   -2.975100      0.1233000      1.9999999E-04
 C    1.124700       1.174200      1.0000000E-03
 C   -4.376600     -0.2363000     -9.9999997E-05
 C   -1.248600       1.813100     -1.2000001E-03
 C  -0.6483000     -0.5271000      2.6000000E-03
 C   -2.599700       1.466500     -1.5000000E-03
 C   -1.999400     -0.8736000      2.2000000E-03
 C    3.214200      0.7620000      3.0000001E-04
 C    4.351900     -0.1154000     -6.0000003E-04
 C    1.828700       2.344100     -6.0000003E-04
 C   -5.053000     -0.4078000       1.207700    
 C   -5.051400     -0.4113000      -1.208200    
 C    4.172200      -1.501700      9.9999997E-05
 C    5.646200      0.4124000     -1.0000000E-03
 C   -6.404200     -0.7543000       1.207400    
 C   -6.402600     -0.7576000      -1.208600    
 C   -7.078900     -0.9292000     -6.9999998E-04
 C    5.277300      -2.352800      3.9999999E-04
 C    6.751400     -0.4385000     -7.9999998E-04
 C    6.566800      -1.821300       0.000000    
 H  -0.9849000       2.867700     -2.6000000E-03
 H   8.3200000E-02  -1.331200      4.3000001E-03
 H   -3.347700       2.256000     -3.0000000E-03
 H   -2.275400      -1.925500      3.5999999E-03
 H    1.461300       3.359800     -1.8000000E-03
 H   -4.542100     -0.2752000       2.158400    
 H   -4.539400     -0.2814000      -2.158800    
 H    3.183900      -1.955000      6.0000003E-04
 H    5.815200       1.486700     -1.3000000E-03
 H   -6.930900     -0.8879000       2.147800    
 H   -6.928100     -0.8939000      -2.149300    
 H   -8.131000      -1.198900     -1.1000000E-03
 H    5.134300      -3.429400      1.0000000E-03
 H    7.755600     -2.5000000E-02 -1.1000000E-03
 H    7.427300      -2.483900      1.9999999E-04


%chk=000070064-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000070064

0 1
O 2.064782 0.023538 -0.000220
N 3.233683 1.991786 -0.001664
C -0.298517 0.748677 -0.000897
C -3.091416 0.112490 -0.000465
C 1.120826 1.081854 -0.001055
C -4.556854 -0.218553 -0.000150
C -1.279457 1.780079 -0.001773
C -0.734905 -0.605114 0.000175
C -2.651051 1.463826 -0.001549
C -2.109807 -0.913608 0.000371
C 3.335857 0.656236 -0.000639
C 4.533395 -0.175172 0.000072
C 1.856054 2.267068 -0.001891
C -5.262247 -0.375524 1.222163
C -5.262367 -0.377562 -1.222134
C 4.447339 -1.594774 0.000647
C 5.810583 0.451865 0.000153
C -6.642004 -0.684308 1.222716
C -6.642125 -0.686347 -1.222026
C -7.336586 -0.840760 0.000510
C 5.623960 -2.372010 0.001322
C 6.980626 -0.332725 0.000823
C 6.893883 -1.746618 0.001415
H -0.969140 2.831087 -0.002624
H 0.009225 -1.407716 0.000865
H -3.393699 2.269483 -0.002210
H -2.431057 -1.961267 0.001207
H 1.492540 3.290913 -0.002571
H -4.726312 -0.254635 2.170780
H -4.726527 -0.258254 -2.171002
H 3.464052 -2.075894 0.000551
H 5.860981 1.545550 -0.000316
H -7.172237 -0.802163 2.174754
H -7.172463 -0.805791 -2.173805
H -8.406074 -1.080296 0.000757
H 5.551578 -3.465300 0.001768
H 7.960894 0.156551 0.000890
H 7.805884 -2.354013 0.001953


