%chk=000080301.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080301

0 1
 O   0.5741000      -1.903100      8.5900001E-02
 C    2.934400      0.2468000     -0.4970000    
 C    2.606900     -0.1031000      0.9662000    
 C    1.130100      9.0700001E-02   1.323500    
 C    2.583300       1.694200     -0.8440000    
 C    4.419200     -4.6000001E-03 -0.7708000    
 C   0.2175000     -0.7993000      0.4917000    
 C   -1.156500     -0.3138000      0.1691000    
 C   -1.784400      0.5269000       1.059300    
 C   -1.741700     -0.7256000      -1.006300    
 C   -3.068400      0.9808000      0.7574000    
 C   -3.025600     -0.2714000      -1.308400    
 C   -3.688900      0.5817000     -0.4264000    
 H    2.366800     -0.4087000      -1.167900    
 H    2.893500      -1.144600       1.160600    
 H    3.212100      0.5179000       1.638800    
 H   0.9784000     -0.1769000       2.375800    
 H   0.8585000       1.143700       1.206600    
 H    2.922500       1.943700      -1.855500    
 H    1.502500       1.862000     -0.8203000    
 H    3.056000       2.395600     -0.1484000    
 H    4.681600      -1.047600     -0.5642000    
 H    5.052700      0.6351000     -0.1469000    
 H    4.662100      0.1978000      -1.819400    
 H   -1.331600      0.8366000       1.995400    
 H   -1.234400      -1.384800      -1.703900    
 H   -3.587000       1.641600       1.445900    
 H   -3.508400     -0.5812000      -2.230700    
 H   -4.688900      0.9346000     -0.6610000    


%chk=000080301-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000080301

0 1
O 0.606077 -1.494648 -0.714947
C 3.228087 0.420910 -0.503144
C 2.544147 -0.083163 0.798261
C 1.046178 0.259549 0.927377
C 3.288183 1.966221 -0.573046
C 4.651230 -0.175753 -0.610347
C 0.138220 -0.563266 0.004588
C -1.337831 -0.258486 -0.015384
C -1.924654 0.740679 0.807950
C -2.170564 -1.009535 -0.889382
C -3.314450 0.982072 0.757210
C -3.557147 -0.767168 -0.941680
C -4.133292 0.230309 -0.117564
H 2.636221 0.047445 -1.361800
H 2.655231 -1.183269 0.847235
H 3.085689 0.341550 1.668847
H 0.704333 0.082226 1.969173
H 0.869643 1.337364 0.740490
H 3.782652 2.296657 -1.505576
H 2.283930 2.429633 -0.552239
H 3.868554 2.373426 0.278424
H 4.618703 -1.280894 -0.621198
H 5.275853 0.139287 0.248892
H 5.156801 0.159787 -1.534990
H -1.303415 1.328793 1.491110
H -1.700136 -1.776528 -1.513800
H -3.759473 1.752476 1.396446
H -4.190386 -1.350253 -1.619261
H -5.211986 0.419581 -0.156548


