%chk=000041890.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041890

0 1
 O    3.547800      -1.942000      0.4641000    
 N   0.3529000       1.300500      7.7100001E-02
 N   0.5137000      -2.224100     -9.8800004E-02
 C  -0.2729000      7.9599999E-02  9.6000005E-03
 C    1.712300       1.125100      8.2000002E-02
 C    1.963500     -0.2275000      1.5799999E-02
 C   0.7113000     -0.8887000     -2.9700000E-02
 C   -1.708100     -6.4400002E-02 -1.1700000E-02
 C  -0.3167000       2.584000      0.1351000    
 C    2.647900       2.268900      0.1492000    
 C    3.275600     -0.8122000     -7.9999998E-04
 C   -2.413200     -0.1949000       1.184900    
 C   -2.391000     -7.3700003E-02  -1.228000    
 C    4.440000     -3.7099998E-02 -0.6153000    
 C   -3.800800     -0.3351000       1.165200    
 C   -3.778700     -0.2139000      -1.247700    
 C   -4.483500     -0.3445000     -5.0999999E-02
 H  -0.1525000       3.009200       1.128800    
 H   0.1033000       3.231500     -0.6397000    
 H   -1.387800       2.483100     -4.3900002E-02
 H    3.450200       2.078400      0.8678000    
 H    3.082800       2.477700     -0.8327000    
 H    2.169300       3.191500      0.4906000    
 H    1.280600      -2.889300     -0.1249000    
 H  -0.4119000      -2.641100     -0.1288000    
 H   -1.895900     -0.1892000       2.141400    
 H   -1.856300      2.7200000E-02  -2.169400    
 H    4.116100      0.5266000      -1.493200    
 H    5.193400     -0.7544000     -0.9586000    
 H    4.903600      0.6106000      0.1304000    
 H   -4.349800     -0.4368000       2.096700    
 H   -4.310500     -0.2211000      -2.194600    
 H   -5.564000     -0.4535000     -6.6399999E-02


%chk=000041890-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000041890

0 1
O 3.233650 -2.118675 -0.815529
N 0.382077 1.376982 0.196749
N 0.529188 -2.128966 -0.727390
C -0.306735 0.160755 -0.109014
C 1.751739 1.205924 0.098697
C 1.994962 -0.151383 -0.279136
C 0.689396 -0.794996 -0.411924
C -1.759171 -0.023079 -0.032617
C -0.279637 2.675472 0.396257
C 2.697669 2.354008 0.328425
C 3.244454 -0.868443 -0.501915
C -2.556533 0.530009 1.016495
C -2.424139 -0.820165 -1.015429
C 4.599605 -0.174727 -0.369856
C -3.948606 0.308477 1.069804
C -3.813237 -1.053403 -0.949777
C -4.588311 -0.487657 0.090498
H -0.311165 2.961892 1.464278
H 0.247456 3.463433 -0.166742
H -1.311807 2.614043 0.021696
H 3.630999 2.008738 0.798352
H 2.977539 2.863697 -0.615959
H 2.258134 3.114082 0.996993
H 1.400323 -2.660222 -0.850439
H -0.385698 -2.570173 -0.696768
H -2.073588 1.100647 1.817924
H -1.846948 -1.216734 -1.858938
H 4.647755 0.756993 -0.960451
H 5.377404 -0.870096 -0.722276
H 4.810824 0.080175 0.686292
H -4.533100 0.742119 1.889596
H -4.295557 -1.663574 -1.722272
H -5.668241 -0.664752 0.137874


