%chk=000096572.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096572

0 1
 O   -1.211800       3.222700      1.0000000E-03
 O   0.9817000       3.306700      3.1000001E-03
 O   -2.271600      -2.921900      7.3000002E-03
 O   -3.470000      -1.082700      6.9999998E-04
 O    2.475100      -2.759900     -2.2000000E-03
 O    3.548600     -0.8450000      8.9999998E-04
 N  -9.2000000E-02   2.663400      8.9999998E-04
 N    2.397300       1.332100      2.6000000E-03
 N   -2.363700      -1.671900      1.6000000E-03
 N    2.484700      -1.506800     -5.0000002E-04
 C   -1.220400      0.4987000     -3.4000000E-03
 C  -3.7500001E-02   1.238200     -1.4000000E-03
 C    1.194200      0.5834000       0.000000    
 C   -1.171700     -0.8952000     -3.8000001E-03
 C    1.242900     -0.8107000     -5.0000002E-04
 C   5.9999999E-02  -1.549900     -2.4000001E-03
 C   -2.545800       1.198800     -4.1000000E-03
 H   9.7199999E-02  -2.636700     -2.0999999E-03
 H   -2.717600       1.688300      0.9619000    
 H   -2.551600       1.908400     -0.8421000    
 H   -3.501200      0.7728000     -0.2762000    
 H    3.297500      0.8772000      5.2999998E-03
 H    2.395500       2.340100     -1.4000000E-03


%chk=000096572-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000096572

0 1
O -1.047985 3.303775 0.759813
O 0.895670 3.449198 -0.402495
O -2.236326 -2.929262 -0.403945
O -3.465876 -1.265640 0.556251
O 2.402910 -2.879522 0.136230
O 3.644697 -0.976395 0.067884
N -0.077741 2.752100 0.119910
N 2.425869 1.345409 -0.088072
N -2.371186 -1.726831 0.049708
N 2.494588 -1.597975 0.085433
C -1.275187 0.573490 -0.025049
C -0.041053 1.282030 0.004401
C 1.268097 0.643407 -0.023600
C -1.175421 -0.850589 0.020515
C 1.256097 -0.803962 0.048355
C 0.056530 -1.521669 0.057513
C -2.609170 1.269070 -0.200240
H 0.084699 -2.614345 0.082033
H -3.082744 1.461525 0.777786
H -2.498324 2.239465 -0.704930
H -3.303151 0.633235 -0.769542
H 3.302492 0.807196 -0.042948
H 2.372316 2.356392 -0.259810


