%chk=000107817.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000107817

0 1
 O    2.817200       1.762200      0.3622000    
 O    5.374200      0.3594000       1.723400    
 O   -1.494900      -1.578600      -1.703500    
 O   -3.827500       1.167400       1.939200    
 O   -4.151900       1.374300      -1.873600    
 O   -2.401900       2.142800     -0.6504000    
 N    5.392400      0.3017000     -0.6266000    
 N   -2.026200     -0.4527000      0.2561000    
 N   0.5644000      -2.831900     -0.3882000    
 C    3.457100      0.5216000      4.7300000E-02
 C    2.523700     -0.6315000      0.3991000    
 C    4.124500      0.4104000      -1.329200    
 C    1.156000     -0.4194000     -0.2540000    
 C    4.868700      0.3825000      0.6249000    
 C   0.1389000      -1.517400      8.8500001E-02
 C   -1.197700      -1.195800     -0.5737000    
 C   -3.357800     -3.6499999E-02 -0.1210000    
 C   -4.295200      0.1293000       1.079300    
 C   -4.444900      -1.151700       1.891600    
 C   -3.219200       1.263800     -0.8914000    
 H    2.957800      -1.588900      8.6999997E-02
 H    2.395100     -0.6829000       1.487800    
 H    4.067500       1.304200      -1.956900    
 H    3.891300     -0.4774000      -1.923100    
 H    1.275100     -0.3479000      -1.343700    
 H   0.7340000      0.5445000      5.8100000E-02
 H    6.351300      0.1952000     -0.9276000    
 H   7.4000000E-03  -1.573800       1.175300    
 H    2.701800       1.759400       1.328000    
 H   -3.758400     -0.7959000     -0.8041000    
 H   -1.662500     -0.1200000       1.144600    
 H   0.6893000      -2.814200      -1.399500    
 H  -0.1585000      -3.523300     -0.1938000    
 H   -5.288000      0.4334000      0.7258000    
 H   -3.499700      -1.439900       2.363700    
 H   -4.797300      -1.979100       1.268500    
 H   -5.161900     -0.9996000       2.705900    
 H   -3.882900       2.007000       1.452700    
 H   -4.074400       2.224500      -2.356800    


%chk=000107817-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000107817

0 1
O 3.095018 1.943590 -0.086206
O 5.576527 0.474888 1.517578
O -1.590811 -1.687374 -1.440583
O -3.975338 0.682682 2.201625
O -3.054091 1.661948 -1.945244
O -3.654767 2.552933 0.106772
N 5.439453 0.013076 -0.867572
N -2.086125 -0.274748 0.344806
N 0.638206 -2.752431 -0.006639
C 3.528937 0.543012 -0.115374
C 2.486540 -0.410744 0.476030
C 4.111493 0.196167 -1.532075
C 1.120636 -0.323865 -0.234225
C 5.006707 0.352857 0.412275
C 0.133089 -1.402337 0.298692
C -1.258770 -1.148599 -0.341328
C -3.428083 0.090856 -0.129626
C -4.462440 -0.063378 1.024156
C -4.649978 -1.517351 1.456803
C -3.404784 1.548954 -0.611470
H 2.850325 -1.453519 0.410572
H 2.372768 -0.180365 1.555955
H 4.070856 1.047694 -2.230015
H 3.712074 -0.721163 -1.995624
H 1.245257 -0.483751 -1.324035
H 0.691043 0.687423 -0.107836
H 6.359076 -0.231042 -1.240230
H 0.061905 -1.297319 1.400232
H 3.144105 2.263773 0.851566
H -3.659764 -0.566259 -0.986198
H -1.851217 0.053616 1.287318
H 0.470989 -2.982934 -0.996425
H 0.244480 -3.480728 0.600428
H -5.430066 0.361533 0.682061
H -3.690853 -1.954326 1.784041
H -5.050377 -2.127042 0.627571
H -5.354820 -1.561038 2.303464
H -3.970907 1.647974 1.947917
H -2.999392 2.622538 -2.207256


