%chk=000089938.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089938

0 1
 O    2.363100       1.837500     -6.9300003E-02
 O    1.918300      -2.216100     -0.4515000    
 O   -3.654400      0.2416000     -0.4499000    
 O    3.279800     -0.6649000      0.5677000    
 O   -2.973000      -1.575500      0.7883000    
 C    1.006000     -0.1350000      8.4299996E-02
 C    1.134700       1.251300     -2.0999999E-03
 C   -1.399000      9.1600001E-02  0.1342000    
 C  -0.2609000     -0.7148000      0.1525000    
 C  -3.5000001E-03   2.057600     -2.0400001E-02
 C   -1.270300       1.477800      4.7899999E-02
 C    2.181200     -0.9950000      0.1048000    
 C   -2.719900     -0.5123000      0.2063000    
 C    2.397900       3.260400     -0.1554000    
 C    2.999000      -3.154300     -0.4886000    
 C   -4.999000     -0.2499000     -0.4488000    
 H  -0.3776000      -1.793300      0.2316000    
 H   1.7800000E-02   3.140100     -8.2800001E-02
 H   -2.138900       2.131300      4.4500001E-02
 H    1.977400       3.730000      0.7404000    
 H    1.928500       3.621500      -1.076900    
 H    3.451900       3.554000     -0.2013000    
 H    3.332900      -3.385000      0.5273000    
 H    3.824300      -2.755200      -1.085600    
 H    2.636700      -4.072900     -0.9577000    
 H   -5.619800      0.4554000      -1.007500    
 H   -5.375300     -0.3159000      0.5763000    
 H   -5.043900      -1.226000     -0.9408000    


%chk=000089938-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000089938

0 1
O 2.402299 1.896845 -0.071155
O 1.901987 -2.291683 -0.309654
O -3.813780 0.324926 -0.151876
O 3.413549 -0.634345 0.307821
O -2.914628 -1.826380 -0.127065
C 1.032340 -0.086408 -0.054927
C 1.131334 1.347037 -0.063552
C -1.429613 0.112691 -0.105885
C -0.253691 -0.672191 -0.084327
C -0.052557 2.135843 -0.084864
C -1.316758 1.526057 -0.103219
C 2.242483 -0.960969 0.008187
C -2.742915 -0.581939 -0.128305
C 2.537825 3.360003 -0.085540
C 3.018486 -3.258328 -0.234852
C -5.159910 -0.289951 -0.175994
H -0.341398 -1.761415 -0.086562
H 0.014063 3.226857 -0.089877
H -2.225096 2.134550 -0.117518
H 2.083572 3.812665 0.815976
H 2.086764 3.796355 -0.997010
H 3.622758 3.534485 -0.084261
H 3.429740 -3.293833 0.788473
H 3.822185 -2.971405 -0.934032
H 2.572657 -4.222600 -0.516785
H -5.857298 0.559545 -0.186026
H -5.310483 -0.918384 0.718006
H -5.279917 -0.914027 -1.077677


