%chk=000101611.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101611

0 1
 O   0.6279000      8.1000002E-03 -0.3048000    
 O  -0.6824000     -0.8381000       1.390100    
 N    4.184300     -0.9314000     -3.9200000E-02
 C   -1.669100      0.5585000     -0.3586000    
 C   -1.711400       2.022400      0.1282000    
 C    2.987600     -0.3174000     -0.5948000    
 C   -2.994100     -0.1773000     -0.2314000    
 C  -0.5601000       2.867800     -0.4265000    
 C  -0.5489000     -0.1816000      0.3657000    
 C    1.774900     -0.6279000      0.2680000    
 C    5.221800      -1.066100      -1.064800    
 C    4.690400     -0.1499000       1.091800    
 C  -0.6196000       4.295600      9.3900003E-02
 C   -3.356100      -1.131500      -1.182400    
 C   -3.847300      0.1017000      0.8363000    
 C    5.660100      0.2928000      -1.583900    
 C    5.899700     -0.8182000       1.723600    
 C   -4.571200      -1.806500      -1.065800    
 C   -5.062300     -0.5736000      0.9529000    
 C   -5.424200      -1.527500      1.8000000E-03
 H   -1.425400      0.5665000      -1.430800    
 H   -1.679100       2.059900       1.224900    
 H   -2.654800       2.489900     -0.1831000    
 H    2.772600     -0.7094000      -1.598500    
 H    3.076300      0.7705000     -0.7134000    
 H   0.4073000       2.448300     -0.1357000    
 H  -0.5982000       2.878400      -1.521800    
 H    1.603700      -1.710700      0.3061000    
 H    1.895200     -0.2492000       1.287900    
 H    6.082600      -1.640800     -0.7073000    
 H    4.828400      -1.659400      -1.900500    
 H    4.908800      0.8965000      0.8508000    
 H    3.927500     -0.1160000       1.877700    
 H  -0.5458000       4.319100       1.185900    
 H   0.2085000       4.882900     -0.3151000    
 H   -1.556500       4.780800     -0.1981000    
 H   -2.699700      -1.360700      -2.017600    
 H   -3.587500      0.8272000       1.601000    
 H    4.843100      0.8876000      -2.001600    
 H    6.193100      0.8906000     -0.8396000    
 H    6.369900      0.1377000      -2.405700    
 H    5.724400      -1.884000       1.906700    
 H    6.805500     -0.7068000       1.120200    
 H    6.110200     -0.3530000       2.693300    
 H   -4.852600      -2.550100      -1.805700    
 H   -5.725300     -0.3593000       1.786100    
 H   -6.369800      -2.054000      9.3300000E-02


%chk=000101611-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000101611

0 1
O 0.703228 0.328073 -0.202912
O -0.380953 0.642439 1.832706
N 4.204995 -0.965944 0.125462
C -1.554838 1.173372 -0.289802
C -2.202439 2.450494 0.319209
C 2.950339 -0.530084 -0.533075
C -2.578022 0.038080 -0.440956
C -1.259769 3.674389 0.330482
C -0.385731 0.705938 0.580363
C 1.888307 -0.218158 0.529950
C 4.885984 -2.101930 -0.544141
C 5.080641 0.170288 0.509804
C -1.939222 4.930094 0.917321
C -2.999662 -0.370759 -1.730472
C -3.144773 -0.590807 0.698119
C 5.514223 -1.803874 -1.933680
C 6.170644 -0.215191 1.526662
C -3.975742 -1.381872 -1.883648
C -4.117210 -1.603325 0.545859
C -4.538892 -2.001339 -0.744682
H -1.146134 1.411275 -1.288655
H -2.528457 2.224866 1.352691
H -3.113550 2.685353 -0.265233
H 2.574001 -1.342025 -1.181332
H 3.088369 0.363608 -1.185165
H -0.354686 3.436754 0.924238
H -0.916002 3.885533 -0.702915
H 1.586700 -1.124918 1.081347
H 2.231516 0.535151 1.261512
H 5.668825 -2.484838 0.136180
H 4.143518 -2.916275 -0.646666
H 5.555554 0.652822 -0.381744
H 4.433868 0.942602 0.967670
H -2.260240 4.753037 1.960859
H -1.253466 5.797090 0.917251
H -2.836492 5.208110 0.332543
H -2.561686 0.103810 -2.617263
H -2.810823 -0.295555 1.699639
H 4.754220 -1.434976 -2.647088
H 6.316233 -1.046239 -1.866123
H 5.956985 -2.724836 -2.356798
H 5.716176 -0.703552 2.406690
H 6.917996 -0.905727 1.095760
H 6.710906 0.688042 1.864880
H -4.292776 -1.686222 -2.887683
H -4.544910 -2.083751 1.433248
H -5.294353 -2.786627 -0.860908


