%chk=000080226.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080226

0 1
 O   -2.952800      -1.434100      6.0500000E-02
 C    2.170800     -0.2817000     -2.8700000E-02
 C   0.8943000      0.5621000      4.1000001E-02
 C    3.454900      0.5468000      4.9400002E-02
 C  -0.3896000     -0.2727000     -1.1800000E-02
 C    4.695300     -0.3477000     -1.1600000E-02
 C   -1.647100      0.5970000     -8.3999997E-03
 C    5.980100      0.4795000      2.8100001E-02
 C   -2.939800     -0.2040000      1.1100000E-02
 C   -4.237200      0.5828000      3.1000001E-03
 C   -5.472700     -0.3097000     -2.4400000E-02
 C    7.214200     -0.4036000     -6.5700002E-02
 C   -6.770200      0.4854000     -4.2500000E-02
 H    2.167500     -0.8579000     -0.9623000    
 H    2.161200      -1.009700      0.7921000    
 H   0.9016000       1.152100      0.9658000    
 H   0.8945000       1.277100     -0.7912000    
 H    3.475300       1.265500     -0.7787000    
 H    3.462900       1.125500      0.9809000    
 H  -0.3842000     -0.8995000     -0.9123000    
 H  -0.4111000     -0.9573000      0.8452000    
 H    4.683900      -1.051800      0.8294000    
 H    4.672200     -0.9437000     -0.9322000    
 H   -1.659200       1.231700     -0.9014000    
 H   -1.646700       1.243800      0.8762000    
 H    5.988200       1.195600     -0.8019000    
 H    6.020700       1.059300      0.9575000    
 H   -4.229900       1.232200     -0.8794000    
 H   -4.252400       1.214000      0.8984000    
 H   -5.441100     -0.9598000     -0.9073000    
 H   -5.473100     -0.9704000      0.8511000    
 H    7.220000     -0.9718000      -1.001400    
 H    7.253300      -1.112600      0.7674000    
 H    8.121200      0.2081000     -3.4200002E-02
 H   -6.822300       1.127800     -0.9271000    
 H   -7.630100     -0.1914000     -6.1500002E-02
 H   -6.853300       1.117500      0.8473000    


%chk=000080226-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000080226

0 1
O -2.991841 -1.522341 -0.255786
C 2.172725 -0.318495 0.014349
C 0.885553 0.532535 -0.071748
C 3.468475 0.521531 -0.044863
C -0.402889 -0.316299 -0.002315
C 4.754668 -0.331944 0.030887
C -1.682262 0.536249 -0.095249
C 6.051634 0.507457 -0.026281
C -2.983996 -0.272709 -0.092056
C -4.276316 0.523037 0.122481
C -5.566450 -0.264555 -0.177619
C 7.330940 -0.354051 0.048587
C -6.837636 0.560412 0.112483
H 2.177019 -1.058013 -0.813338
H 2.160136 -0.907282 0.955323
H 0.885949 1.278453 0.751121
H 0.895894 1.113995 -1.018078
H 3.478243 1.115366 -0.983123
H 3.467547 1.256453 0.787539
H -0.409086 -1.064858 -0.816947
H -0.418903 -0.897411 0.940671
H 4.746044 -0.927617 0.967826
H 4.757926 -1.065516 -0.802469
H -1.671613 1.135611 -1.032523
H -1.725387 1.283926 0.724139
H 6.058575 1.102381 -0.962607
H 6.048181 1.239893 0.806827
H -4.227837 1.453235 -0.481601
H -4.279253 0.865798 1.180871
H -5.555987 -0.588148 -1.235923
H -5.565745 -1.194332 0.420275
H 7.371352 -1.075985 -0.788972
H 7.363440 -0.933344 0.990802
H 8.243689 0.268310 0.002789
H -6.868733 1.482197 -0.499329
H -7.749747 -0.021941 -0.111884
H -6.885011 0.862401 1.176243


