%chk=000066857.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000066857

0 1
 O    1.999200       1.541900      3.0000001E-04
 O    4.256900      0.3234000      3.0000001E-04
 O    3.204600      -1.704700     -1.7000000E-03
 N   0.7708000     -0.4760000      8.9999998E-04
 N   -3.950700      -1.569400      3.9999999E-04
 C  -0.5633000     -6.7500003E-02  1.1000000E-03
 C   -1.584300      -1.017800      7.9999998E-04
 C   -2.917800     -0.6087000     -3.9999999E-04
 C  -0.8758000       1.291900      3.0000001E-04
 C   -3.230300      0.7507000     -1.2000001E-03
 C   -2.209400       1.701000     -7.9999998E-04
 C    1.910400      0.3249000       0.000000    
 C    3.189700     -0.4898000       0.000000    
 H   -1.342200      -2.078600      1.5000000E-03
 H  -0.1387000       2.083200      3.0000001E-04
 H   -4.265500       1.082200     -1.9000000E-03
 H   -2.453900       2.759300     -1.3000000E-03
 H   0.9191000      -1.483000      1.0000000E-03
 H   -4.917600      -1.272900     -2.3000001E-03
 H   -3.725200      -2.555300     -7.9999998E-04
 H    5.102400     -0.1739000     -5.0000002E-04


%chk=000066857-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000066857

0 1
O 2.028402 1.652820 -0.000784
O 4.364318 0.168312 0.000652
O 3.112011 -1.789060 0.000842
N 0.797421 -0.377628 -0.000200
N -3.902334 -1.630679 -0.000359
C -0.559007 0.050090 -0.000244
C -1.546245 -0.968416 -0.000294
C -2.925754 -0.633912 -0.000395
C -0.925452 1.422171 -0.000328
C -3.296376 0.744339 -0.000433
C -2.301086 1.738799 -0.000408
C 1.945864 0.394031 -0.000220
C 3.179186 -0.532040 -0.001015
H -1.242241 -2.023757 -0.000259
H -0.156057 2.194441 -0.000337
H -4.357081 1.021734 -0.000469
H -2.601900 2.792534 -0.000458
H 0.973300 -1.390664 -0.000119
H -4.888459 -1.388797 -0.000537
H -3.650514 -2.614358 -0.000499
H 5.130405 -0.469062 0.001864


