%chk=000088481.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088481

0 1
 O   -1.295200     -0.5782000     -0.3351000    
 O   -2.923500      4.2900000E-02   1.181400    
 C    1.042300      4.0300000E-02 -0.3999000    
 C    1.520200      -1.344200      4.5699999E-02
 C  -0.3502000      0.3627000      0.1682000    
 C    2.061900       1.112400      9.1000004E-03
 C  -0.8025000       1.771900     -0.2179000    
 C    1.598800       2.514200     -0.3795000    
 C   0.2185000       2.827200      0.1881000    
 C    2.893600      -1.641900     -0.5769000    
 C    1.638000      -1.382000       1.577700    
 C   0.5129000      -2.410800     -0.4128000    
 C   -2.579600     -0.4183000      0.1015000    
 C   -3.535200     -0.8961000     -0.9496000    
 H   0.9669000      4.1800000E-02  -1.497700    
 H  -0.3453000      0.3136000       1.262200    
 H    3.029900      0.9509000     -0.4748000    
 H    2.233800       1.125600       1.089100    
 H   -1.762900       2.031700      0.2396000    
 H  -0.9717000       1.818600      -1.302000    
 H    1.571900       2.599700      -1.473000    
 H    2.321400       3.255700     -1.9900000E-02
 H   0.2755000       2.880000       1.282300    
 H  -0.1087000       3.812300     -0.1630000    
 H    3.180200      -2.686700     -0.4057000    
 H    3.696000      -1.037100     -0.1431000    
 H    2.884700      -1.481300      -1.660700    
 H   0.6914000      -1.217700       2.098200    
 H    2.385900     -0.6942000       1.979700    
 H    1.969100      -2.382600       1.887700    
 H   0.9882000      -3.400800     -0.4033000    
 H   0.1734000      -2.250900      -1.442100    
 H  -0.3416000      -2.520100      0.2620000    
 H   -3.361200      -1.955600      -1.154000    
 H   -3.411500     -0.3028000      -1.859000    
 H   -4.560800     -0.7744000     -0.5899000    


%chk=000088481-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000088481

0 1
O -1.419760 -0.304589 -0.430682
O -2.685299 0.121187 1.488909
C 1.045304 0.123263 -0.451383
C 1.427375 -1.364009 -0.056872
C -0.332337 0.612129 0.064291
C 2.095059 1.175381 0.030679
C -0.690956 2.032749 -0.416953
C 1.769359 2.616497 -0.428855
C 0.369088 3.055459 0.046251
C 2.954166 -1.605299 -0.247004
C 1.067616 -1.678573 1.421441
C 0.700144 -2.371253 -0.995151
C -2.556462 -0.432826 0.371850
C -3.582577 -1.316997 -0.306071
H 1.022970 0.166577 -1.563053
H -0.362313 0.587657 1.170624
H 3.092215 0.895935 -0.350270
H 2.158673 1.152829 1.139000
H -1.688566 2.303392 -0.025007
H -0.751972 2.029558 -1.523378
H 1.810610 2.663453 -1.536904
H 2.542747 3.312141 -0.049342
H 0.357354 3.126172 1.153082
H 0.118586 4.060728 -0.342216
H 3.170525 -2.685169 -0.141848
H 3.563306 -1.070930 0.503796
H 3.292665 -1.293956 -1.254072
H -0.023859 -1.692465 1.591149
H 1.513191 -0.942096 2.116951
H 1.457387 -2.675841 1.699490
H 0.948946 -3.410184 -0.704681
H 1.024433 -2.227470 -2.044152
H -0.392397 -2.243903 -0.960804
H -3.114580 -2.248126 -0.668091
H -4.001094 -0.795864 -1.185679
H -4.394946 -1.549756 0.397555


