%chk=000001220.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001220

0 1
 O    1.981800      -1.356400       2.257300    
 N   -2.112400      0.1759000     -0.5274000    
 C  -0.6846000      9.2799999E-02 -0.8313000    
 C  -0.2003000       1.408500      -1.443400    
 C   0.1160000     -0.2196000      0.4406000    
 C    1.264100       1.290200      -1.867000    
 C    1.606900     -7.6899998E-02  0.2513000    
 C    2.145400      0.6694000     -0.8127000    
 C   -2.366100       1.232400      0.4515000    
 C   -2.605300      -1.108900     -3.2299999E-02
 C   -3.861300       1.339500      0.7399000    
 C   -2.426700      -2.190100      -1.095000    
 C    2.471000     -0.6536000       1.194700    
 C    3.538200      0.7926000     -0.9317000    
 C    3.853100     -0.5150000       1.070800    
 C    4.386400      0.2057000      6.6000000E-03
 C   -4.154500       2.446900       1.740400    
 C   -2.951900      -3.533300     -0.6122000    
 H  -0.4786000     -0.6588000      -1.599600    
 H  -0.2463000       2.238000     -0.7287000    
 H  -0.8077000       1.689400      -2.312500    
 H  -7.9000004E-02  -1.252300      0.7513000    
 H  -0.1055000      0.4375000       1.283700    
 H    1.638200       2.288600      -2.124400    
 H    1.329300      0.6715000      -2.771000    
 H   -1.885100       1.071700       1.419300    
 H   -2.064300       2.215100      7.9599999E-02
 H   -2.171900      -1.410600      0.9279000    
 H   -3.688000      -1.075300      0.1198000    
 H   -4.418500       1.530000     -0.1851000    
 H   -4.267900      0.4327000       1.196000    
 H   -2.944700      -1.909400      -2.020000    
 H   -1.377000      -2.366900      -1.342900    
 H    3.969600       1.349300      -1.760100    
 H    4.525600     -0.9626000       1.797600    
 H    5.462600      0.3116000     -9.3500003E-02
 H   -3.649400       2.261600       2.693900    
 H   -3.823500       3.418300       1.359100    
 H   -5.230200       2.509100       1.933600    
 H   -2.422100      -3.862100      0.2878000    
 H   -4.020500      -3.477700     -0.3813000    
 H   -2.812900      -4.295700      -1.385300    
 H    2.723800      -1.676100       2.798500    


%chk=000001220-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000001220

0 1
O 2.376980 -0.915686 2.533086
N -1.999851 -0.013227 -0.170270
C -0.547014 0.001216 -0.499429
C -0.139809 1.241408 -1.325980
C 0.392144 -0.131517 0.735020
C 1.283357 1.053187 -1.893631
C 1.864614 0.039982 0.385436
C 2.297740 0.611098 -0.841358
C -2.458996 1.005335 0.805024
C -2.545535 -1.374592 0.064907
C -3.897137 1.495677 0.518698
C -2.898113 -2.118171 -1.243567
C 2.854212 -0.366111 1.321054
C 3.685154 0.759051 -1.103700
C 4.235059 -0.226967 1.062258
C 4.647816 0.341467 -0.163671
C -4.384398 2.521738 1.564659
C -3.419263 -3.548570 -0.984155
H -0.376080 -0.881122 -1.150190
H -0.167762 2.149618 -0.691191
H -0.868820 1.382727 -2.144501
H 0.248468 -1.106297 1.236949
H 0.114261 0.632627 1.490152
H 1.633662 1.987211 -2.373399
H 1.249375 0.289611 -2.699345
H -2.406929 0.636448 1.860675
H -1.781751 1.878215 0.747471
H -1.845331 -2.007024 0.664995
H -3.466838 -1.280506 0.671286
H -3.919447 1.935301 -0.496483
H -4.588384 0.629663 0.498744
H -3.653575 -1.521995 -1.789760
H -2.004229 -2.162230 -1.896894
H 4.005662 1.205962 -2.052413
H 4.977227 -0.550779 1.803969
H 5.716005 0.459557 -0.375826
H -4.388771 2.085102 2.581655
H -3.728019 3.412641 1.586459
H -5.410597 2.865751 1.341045
H -2.662490 -4.160398 -0.456936
H -4.332397 -3.534801 -0.358770
H -3.668304 -4.062406 -1.930388
H 3.133906 -1.181195 3.112118


