%chk=000058889.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000058889

0 1
 O   0.3493000       2.858100      0.7074000    
 N   -1.201600     -0.1724000      0.6308000    
 C   -3.955600      5.8800001E-02 -0.3474000    
 C   -2.754100      0.5824000      -1.141400    
 C   -3.506600      -1.069800      0.5869000    
 C   -1.597000      0.9618000     -0.2149000    
 C   -2.325000     -0.6353000       1.456500    
 C   -5.067500     -0.4113000      -1.281100    
 C  -6.2199999E-02  0.1902000       1.473400    
 C    1.136000      0.5910000      0.6546000    
 C   -6.274000     -0.9010000     -0.5032000    
 C    2.084100     -0.3578000      0.2485000    
 C    1.270600       1.934100      0.3131000    
 C    3.193800      6.4999998E-02 -0.5213000    
 C    2.361900       2.349900     -0.4440000    
 C    1.959800      -1.715300      0.5863000    
 C    3.318100       1.422500     -0.8591000    
 C    4.146600     -0.8820000     -0.9305000    
 C    2.916000      -2.642500      0.1712000    
 C    4.007300      -2.226700     -0.5859000    
 H   -4.340900      0.8835000      0.2684000    
 H   -3.050000       1.458000      -1.731900    
 H   -2.414800     -0.1813000      -1.854000    
 H   -3.224000      -1.955000      2.0999999E-03
 H   -4.319300      -1.371400       1.256300    
 H  -0.8020000       1.258600     -0.9028000    
 H   -1.898400       1.826500      0.3892000    
 H   -2.648900      0.1495000       2.152800    
 H   -2.012000      -1.496700       2.059200    
 H   -4.711100      -1.210700      -1.941700    
 H   -5.375300      0.4210000      -1.925600    
 H   0.1918000     -0.6193000       2.166700    
 H  -0.3363000       1.010800       2.152900    
 H   -6.080800      -1.854800     -3.7000000E-03
 H   -6.594400     -0.1692000      0.2453000    
 H   -7.112900      -1.065600      -1.187900    
 H    2.482900       3.394100     -0.7198000    
 H    1.124500      -2.109600       1.155800    
 H    4.163000       1.769900      -1.450200    
 H    5.007500     -0.5795000      -1.523300    
 H    2.806400      -3.690500      0.4347000    
 H    4.750600      -2.949400     -0.9097000    
 H   0.6105000       3.732400      0.3707000    


%chk=000058889-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000058889

0 1
O 0.926547 3.232999 1.245923
N -1.197574 0.022930 0.740772
C -3.928117 -0.189634 -0.402907
C -2.691778 0.227783 -1.238441
C -3.452571 -1.048206 0.796107
C -1.616566 0.911522 -0.372666
C -2.351908 -0.331857 1.603767
C -4.979500 -0.913022 -1.281380
C -0.088168 0.605705 1.555287
C 1.180957 0.879793 0.762770
C -6.312584 -1.219290 -0.563240
C 1.942417 -0.187233 0.156522
C 1.674783 2.189951 0.654098
C 3.188825 0.104484 -0.527932
C 2.898282 2.488209 -0.027386
C 1.505753 -1.555528 0.212377
C 3.640595 1.461501 -0.603989
C 3.947388 -0.964730 -1.108489
C 2.269106 -2.576630 -0.359413
C 3.502036 -2.284874 -1.024796
H -4.395358 0.736109 0.003837
H -2.996907 0.914067 -2.053413
H -2.249575 -0.673193 -1.709142
H -3.050980 -2.008831 0.414851
H -4.297430 -1.282702 1.471775
H -0.726709 1.146407 -0.983862
H -2.014823 1.884156 0.021011
H -2.788579 0.582635 2.089176
H -1.988829 -0.989546 2.417577
H -4.537650 -1.857378 -1.662550
H -5.185806 -0.285548 -2.173075
H 0.137330 -0.128315 2.355550
H -0.407311 1.548915 2.053689
H -6.170910 -1.917488 0.281754
H -6.767801 -0.293542 -0.162257
H -7.040979 -1.680379 -1.255606
H 3.246858 3.527972 -0.088677
H 0.538760 -1.774541 0.673098
H 4.580464 1.684261 -1.122151
H 4.887710 -0.726492 -1.620625
H 1.918036 -3.613591 -0.307506
H 4.087599 -3.097021 -1.469626
H 1.380964 4.101168 1.112588


