%chk=000020954.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020954

0 1
 O    3.020500       1.250900      -1.123900    
 O    3.949800     -0.4280000      9.0099998E-02
 C   -2.429400     -0.4162000     -5.0999999E-02
 C   -1.236900     -0.7874000     -0.9600000    
 C   8.0899999E-02 -4.3699998E-02 -0.6955000    
 C   0.7235000     -0.2888000      0.6842000    
 C   -2.685500       1.103500     -3.5000000E-02
 C    1.936900      0.6284000      0.9144000    
 C   -3.666100      -1.195600     -0.5162000    
 C    1.085100      -1.760600      0.9012000    
 C   -3.853000       1.521900      0.8489000    
 C    3.074400      0.4154000     -5.7200000E-02
 H   -2.198600     -0.7408000      0.9713000    
 H   -1.063300      -1.868900     -0.9087000    
 H   -1.519700     -0.5842000      -2.002100    
 H   0.7867000     -0.3612000      -1.474400    
 H  -6.2100001E-02   1.031300     -0.8536000    
 H  -9.6000005E-03 -1.9099999E-02   1.455000    
 H   -1.798100       1.623300      0.3422000    
 H   -2.859900       1.466900      -1.055000    
 H    1.631000       1.681000      0.8641000    
 H    2.337500      0.4880000       1.926000    
 H   -4.494500      -1.087800      0.1906000    
 H   -3.445500      -2.266100     -0.5898000    
 H   -4.006200     -0.8515000      -1.498800    
 H   0.1865000      -2.383400      0.9507000    
 H    1.622500      -1.894200       1.846200    
 H    1.716200      -2.144500      9.3099996E-02
 H   -3.899700       2.613900      0.9151000    
 H   -4.808900       1.178100      0.4431000    
 H   -3.740400       1.125900       1.863000    
 H    3.760600       1.095500      -1.748600    


%chk=000020954-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000020954

0 1
O 3.217742 1.452384 -0.985792
O 3.793506 -0.638140 -0.165341
C -2.410523 -0.417720 -0.086560
C -1.231680 -0.758085 -1.043034
C 0.118754 -0.052127 -0.760296
C 0.692946 -0.267022 0.666850
C -2.722214 1.103716 -0.070304
C 1.951106 0.635626 0.903993
C -3.651400 -1.253163 -0.485186
C 0.984389 -1.753743 0.976704
C -3.832835 1.519057 0.920411
C 3.066478 0.378521 -0.088132
H -2.123069 -0.714540 0.946201
H -1.078231 -1.856119 -1.030899
H -1.542536 -0.507073 -2.079363
H 0.859722 -0.419995 -1.500072
H 0.019991 1.035989 -0.945776
H -0.058218 0.094425 1.399753
H -1.799587 1.662476 0.183264
H -3.003301 1.419192 -1.097374
H 1.664709 1.698951 0.845228
H 2.349346 0.429298 1.914908
H -4.481966 -1.130837 0.232502
H -3.403982 -2.330634 -0.529676
H -4.019414 -0.951158 -1.485499
H 0.064703 -2.360589 0.898451
H 1.380733 -1.874417 2.002083
H 1.734725 -2.167429 0.280053
H -3.942601 2.618889 0.953643
H -4.814059 1.096436 0.639694
H -3.598288 1.173592 1.945718
H 3.949754 1.236236 -1.626752


