%chk=000227264.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227264

0 1
 O   -2.565200       1.560200       1.171500    
 O   -1.827300       2.417200      -1.414400    
 O   -3.720300     -0.9290000       1.560900    
 O   -3.081000      -3.059800     -9.3000002E-02
 N   0.4351000     -0.1014000      -1.271200    
 N   0.2286000       1.285900      0.4530000    
 C   -2.792800      0.7091000      4.5200001E-02
 C   -1.751100       1.042300      -1.043900    
 C   -2.765200     -0.7582000      0.5123000    
 C  -0.3356000      0.7603000     -0.5813000    
 C    1.640000     -0.1476000     -0.6178000    
 C    1.485900      0.7268000      0.4544000    
 C   -3.101300      -1.734500     -0.6140000    
 C    2.815300     -0.8576000     -0.8653000    
 C    2.557800      0.9163000       1.343000    
 C    3.872000     -0.6567000      2.9100001E-02
 C    3.747600      0.2140000       1.114200    
 C    5.157600      -1.387300     -0.1828000    
 H   -3.793000      0.9684000     -0.3241000    
 H   -1.965600      0.4669000      -1.951300    
 H   -1.796400      -1.016900      0.9549000    
 H   0.1875000     -0.6194000      -2.104500    
 H   -4.109500      -1.554900      -1.000100    
 H   -2.389400      -1.686300      -1.441600    
 H    2.897700      -1.531900      -1.710800    
 H   -3.337800       1.485800       1.756700    
 H    2.470600       1.590200       2.189200    
 H   -2.739300       2.591700      -1.703300    
 H   -3.391900     -0.4472000       2.338800    
 H    4.579200      0.3567000       1.800600    
 H    5.297600      -1.649500      -1.236900    
 H    6.013100     -0.7689000      0.1095000    
 H    5.168100      -2.307500      0.4100000    
 H   -2.180200      -3.233100      0.2297000    


%chk=000227264-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000227264

0 1
O -2.573303 2.103393 -0.281774
O -1.755708 1.142835 -2.536616
O -4.021771 0.844877 1.604976
O -2.214326 -2.374113 1.105852
N 0.636555 0.505562 -1.434658
N -0.151721 -1.040570 0.020492
C -2.902426 0.672070 -0.432895
C -1.864295 0.146883 -1.460840
C -2.974569 0.008436 0.950941
C -0.478654 -0.130411 -0.916242
C 1.770154 -0.011546 -0.788959
C 1.257093 -0.985434 0.131943
C -3.353531 -1.499457 0.922978
C 3.148521 0.260427 -0.909923
C 2.145816 -1.708862 0.957254
C 4.036514 -0.465619 -0.083778
C 3.521246 -1.436504 0.835866
C 5.535786 -0.230463 -0.162017
H -3.906650 0.581851 -0.899868
H -2.251994 -0.782671 -1.915063
H -2.015647 0.131217 1.492470
H 0.569209 1.185751 -2.192410
H -4.050921 -1.697114 1.760757
H -3.907117 -1.730535 -0.017603
H 3.529945 1.005303 -1.616635
H -3.161465 2.449439 0.439832
H 1.769794 -2.455287 1.663121
H -2.006462 2.013101 -2.108139
H -4.087585 0.597378 2.560401
H 4.231490 -1.985802 1.465577
H 5.787365 0.565155 -0.884067
H 5.947225 0.064668 0.821419
H 6.069042 -1.148182 -0.474460
H -1.366810 -1.951677 0.698767


