%chk=000037264.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000037264

0 1
 O    5.558800      0.2825000      4.0600002E-02
 O    4.934600       2.394200     -0.5737000    
 O    7.868300     -0.9815000       1.103600    
 O   -3.632500       2.328400      0.1011000    
 O   -6.228300       1.467900     -0.1045000    
 O   -6.792700      -1.240700     -0.1865000    
 N   0.7522000      4.2100001E-02  0.3908000    
 N    3.407600      0.9834000      0.4616000    
 N   -1.565100      0.5152000      0.2262000    
 N  -0.7747000      -1.761200      0.2489000    
 N   -2.286300      -3.558400      0.1088000    
 C    1.855000     -0.9270000      0.4568000    
 C    1.073600       1.342900     -0.2186000    
 C    3.085400     -0.2913000       1.102900    
 C    2.311300       1.946300      0.4412000    
 C  -0.5659000     -0.4162000      0.2856000    
 C    4.658300       1.309100     -6.5700002E-02
 C    7.765900     -0.6943000     -0.2935000    
 C    6.869000      0.5360000     -0.4796000    
 C   -2.834000      8.1799999E-02  0.1257000    
 C   -3.139300      -1.288300      8.1900001E-02
 C   -2.056500      -2.160800      0.1482000    
 C    7.181700      -1.935100     -0.9698000    
 C    9.172100     -0.4118000     -0.8252000    
 C   -3.891600      0.9857000      6.1400000E-02
 C   -4.469700      -1.729900     -2.3499999E-02
 C   -5.217500      0.5545000     -4.3400001E-02
 C   -5.507100     -0.8048000     -8.6099997E-02
 C   -3.417200       2.978200      -1.147200    
 C   -6.801800       1.881400       1.133500    
 C   -7.313600      -1.428500      -1.501400    
 H    1.582200      -1.804600       1.054600    
 H    2.094900      -1.269700     -0.5574000    
 H    1.249700       1.199400      -1.292100    
 H   0.2570000       2.065600     -0.1100000    
 H    3.926800     -0.9884000       1.061600    
 H    2.890000     -7.5499997E-02   2.160400    
 H    2.097000       2.213600       1.483000    
 H    2.605600       2.861800     -8.1600003E-02
 H    7.292400       1.386400      6.9300003E-02
 H    6.791500      0.7933000      -1.542800    
 H    7.829100      -2.805300     -0.8111000    
 H    6.206300      -2.200000     -0.5465000    
 H    7.062200      -1.785300      -2.047800    
 H    9.835400      -1.266100     -0.6475000    
 H    9.162300     -0.1964000      -1.898500    
 H    9.621200      0.4408000     -0.3030000    
 H   -4.724600      -2.785400     -6.6200003E-02
 H    6.967800      -1.112300       1.447100    
 H   -1.456800      -4.140400      0.1325000    
 H   -3.106600      -3.925900      0.5740000    
 H   -2.545200       2.557400      -1.657700    
 H   -3.228900       4.037900     -0.9538000    
 H   -4.302100       2.892800      -1.785800    
 H   -6.047600       2.356700       1.768600    
 H   -7.587900       2.610700      0.9198000    
 H   -7.248400       1.029000       1.655000    
 H   -6.737500      -2.190100      -2.036400    
 H   -8.348800      -1.769600      -1.414100    
 H   -7.301100     -0.4867000      -2.059000    


%chk=000037264-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000037264

0 1
O 5.489719 0.233994 0.107884
O 4.814962 2.481973 -0.017256
O 7.511057 -1.175179 1.452127
O -3.760185 2.230697 -0.349191
O -6.359710 1.306149 0.233304
O -6.815823 -1.450774 0.720536
N 0.698820 -0.143083 -0.695114
N 3.239257 0.752599 0.191550
N -1.589294 0.362948 -0.469400
N -0.774560 -1.937497 -0.305800
N -2.172491 -3.742613 0.098573
C 1.843060 -1.065187 -0.755895
C 1.037954 1.283883 -0.829431
C 2.900834 -0.681935 0.306730
C 2.087595 1.681010 0.232761
C -0.605884 -0.572814 -0.484042
C 4.515271 1.262077 0.088557
C 7.790590 -0.536789 0.142035
C 6.896580 0.710923 0.000885
C -2.874899 -0.092705 -0.225526
C -3.172511 -1.487162 -0.004225
C -2.028082 -2.383958 -0.073920
C 7.543492 -1.550193 -0.997907
C 9.265351 -0.109691 0.214143
C -3.963913 0.850025 -0.175288
C -4.504026 -1.907108 0.263291
C -5.272262 0.423052 0.147196
C -5.544472 -0.977130 0.346538
C -3.206227 2.648441 -1.657242
C -6.235450 2.429058 1.194205
C -7.931403 -1.157270 -0.207453
H 1.471256 -2.086368 -0.583901
H 2.305710 -1.011396 -1.763619
H 1.448685 1.475720 -1.842208
H 0.114576 1.868298 -0.697797
H 3.813493 -1.279838 0.171494
H 2.487901 -0.880167 1.316940
H 1.623159 1.641582 1.238570
H 2.464049 2.700845 0.054210
H 7.089143 1.429436 0.816315
H 7.034855 1.217210 -0.971222
H 8.131966 -2.464116 -0.808487
H 6.475384 -1.824522 -1.057313
H 7.845975 -1.133688 -1.976707
H 9.896715 -1.000928 0.370283
H 9.583644 0.389158 -0.718755
H 9.427810 0.575325 1.064064
H -4.768526 -2.954969 0.440244
H 6.526173 -1.283028 1.521034
H -1.336339 -4.320397 0.044934
H -3.073219 -4.172940 0.280928
H -2.226861 2.169857 -1.821396
H -3.102248 3.742313 -1.588057
H -3.911663 2.386226 -2.468760
H -5.376225 3.065980 0.930996
H -7.181303 2.984709 1.104750
H -6.125104 2.031852 2.220529
H -7.753206 -1.649015 -1.183911
H -8.823135 -1.589489 0.271720
H -8.050115 -0.069887 -0.342804


