%chk=000039228.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000039228

0 1
 O  -0.8714000      -2.030200     -9.9999997E-05
 O   -4.385600     -0.1060000     -6.0000003E-04
 O   -3.245800       1.860600     -5.0000002E-04
 O    4.124100       1.217400      1.9999999E-04
 O    4.106100     -0.9778000       0.000000    
 N   -2.171500      -1.540100      6.9999998E-04
 N    3.508500      0.1249000     -9.9999997E-05
 C  -0.6999000      0.2029000      1.9999999E-04
 C   4.4999998E-03 -0.9884000     -3.9999999E-04
 C   8.6000003E-03   1.413500      3.0000001E-04
 C   -2.046600     -0.2096000      5.0000002E-04
 C    1.393500      -1.078300     -5.0000002E-04
 C    2.087100      0.1365000     -1.9999999E-04
 C    1.409800       1.360500      9.9999997E-05
 C   -3.221400      0.6141000      1.9999999E-04
 H  -0.5008000       2.371800      6.9999998E-04
 H    1.879600      -2.047000     -6.0000003E-04
 H    1.943500       2.308600      3.0000001E-04
 H   -5.173400      0.4787000     -1.3000000E-03


%chk=000039228-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000039228

0 1
O -0.857025 -2.149011 -0.000132
O -4.473552 -0.022806 -0.000681
O -3.154534 1.896565 -0.000077
O 4.144099 1.310688 -0.000610
O 4.179318 -0.971308 -0.000786
N -2.223946 -1.616996 -0.000304
N 3.560189 0.160505 0.000392
C -0.705627 0.154849 0.000102
C 0.033851 -1.056436 0.000023
C -0.029981 1.401032 0.000268
C -2.091520 -0.267565 0.000007
C 1.432773 -1.120435 0.000081
C 2.067742 0.137562 0.000262
C 1.374569 1.382432 0.000342
C -3.261457 0.647023 0.000159
H -0.596625 2.334708 0.000360
H 2.008019 -2.047934 0.000021
H 1.963200 2.302788 0.000500
H -5.220593 0.636439 -0.001027


