%chk=000022224.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000022224

0 1
 O   -5.374100       3.264100      1.5799999E-02
 O    5.429000       3.200300     -1.9099999E-02
 N   -2.357300     -0.5068000     -9.3000000E-03
 N    2.332500     -0.5202000      9.4999997E-03
 N  -1.2400000E-02 -0.4819000      1.8000000E-03
 N    1.181400      -2.563300      5.1000002E-03
 N   -1.218100      -2.556500     -4.4999998E-03
 C   -2.424300      0.9210000     -8.6000003E-03
 C    2.430500      0.9200000      1.0800000E-02
 C   -3.871800       1.398500     -4.4999998E-03
 C    3.887700       1.366800      3.0000000E-03
 C   -3.995700       2.917600     -5.7000001E-03
 C    4.043600       2.882900      6.0999999E-03
 C   -1.136600      -1.216200     -3.1000001E-03
 C    1.130100      -1.209600      6.0000001E-03
 C  -2.0099999E-02  -3.162900     -9.9999997E-05
 C  -2.4400000E-02  -4.653800     -3.1999999E-03
 H   -1.913200       1.321000      0.8757000    
 H   -1.917200       1.321200     -0.8950000    
 H    1.922900       1.327400     -0.8719000    
 H    1.932300       1.324600      0.9000000    
 H   -4.398600      0.9940000      0.8699000    
 H   -4.405400      0.9923000     -0.8739000    
 H    4.402900      0.9523000     -0.8736000    
 H    4.414900      0.9478000      0.8702000    
 H   -3.204300      -1.063400     -1.4700000E-02
 H    3.178700      -1.078200      1.2700000E-02
 H   -3.541400       3.344900     -0.9052000    
 H   -3.514000       3.348500      0.8777000    
 H    3.601200       3.318300      0.9076000    
 H    3.568400       3.325200     -0.8752000    
 H  -1.5699999E-02  -5.020900      -1.033600    
 H   0.8552000      -5.046100      0.5167000    
 H  -0.9160000      -5.041200      0.4998000    
 H   -5.423700       4.235300      1.4600000E-02
 H    5.499200       4.170100     -1.6600000E-02


%chk=000022224-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000022224

0 1
O -5.598453 3.150087 -0.001200
O 5.634812 3.089843 -0.014917
N -2.351596 -0.477906 0.002668
N 2.349074 -0.502601 0.015607
N -0.000784 -0.396960 0.010039
N 1.201037 -2.536358 0.021097
N -1.225168 -2.523739 0.014278
C -2.477352 0.985017 -0.003114
C 2.490246 0.959085 0.012199
C -3.964622 1.386185 0.000709
C 3.981642 1.344146 0.000838
C -4.147613 2.906338 -0.008230
C 4.181414 2.862271 -0.000558
C -1.154405 -1.141176 0.008568
C 1.144873 -1.153253 0.015156
C -0.015355 -3.160373 0.018419
C -0.023075 -4.667432 -0.009301
H -1.955454 1.403993 0.880278
H -1.962194 1.397235 -0.893820
H 1.969801 1.377998 -0.872036
H 1.982437 1.381993 0.902092
H -4.467636 0.977798 0.898083
H -4.475420 0.966330 -0.886993
H 4.477116 0.924749 -0.895662
H 4.491043 0.924427 0.889417
H -3.185264 -1.067782 0.001638
H 3.176527 -1.101108 0.020535
H -3.675425 3.343021 -0.915578
H -3.664653 3.354731 0.887677
H 3.717802 3.309947 0.905863
H 3.699840 3.310349 -0.897382
H -0.015578 -5.024084 -1.056807
H 0.876706 -5.063445 0.487012
H -0.935365 -5.053720 0.471448
H -5.771745 4.124857 -0.007689
H 5.818986 4.062638 -0.015132


