%chk=000094240.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094240

0 1
 O    5.717900       1.435100     -0.2853000    
 O   0.7587000      -2.386800      0.4456000    
 C    2.091700     -0.4863000      0.1047000    
 C   -2.937200     -0.2460000      4.5200001E-02
 C   0.7874000      -1.177700      0.2444000    
 C    2.187600      0.8422000      0.4689000    
 C    3.172900      -1.191300     -0.3859000    
 C   -1.666200     -0.9391000      0.1866000    
 C  -0.4483000     -0.3586000      9.9799998E-02
 C    3.414600       1.492300      0.3369000    
 C    4.400000     -0.5413000     -0.5176000    
 C   -3.000500       1.136700      0.2173000    
 C   -4.092900     -0.9643000     -0.2621000    
 C    4.520800      0.8006000     -0.1564000    
 C   -4.219500       1.801200      8.1699997E-02
 C   -5.311700     -0.2997000     -0.3978000    
 C   -5.375100       1.083100     -0.2259000    
 H    1.363700       1.405100      0.8947000    
 H    3.093600      -2.234800     -0.6763000    
 H   -1.737500      -2.006700      0.3833000    
 H  -0.3485000      0.6892000     -0.1513000    
 H    3.498300       2.535400      0.6302000    
 H    5.257900      -1.084900     -0.9037000    
 H   -2.132400       1.734900      0.4785000    
 H   -4.063000      -2.042400     -0.4010000    
 H   -4.270600       2.877200      0.2205000    
 H   -6.211500     -0.8588000     -0.6373000    
 H   -6.324300       1.600400     -0.3303000    
 H    5.619500       2.356700      9.8999999E-03


%chk=000094240-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000094240

0 1
O 6.035877 1.200034 0.135200
O 0.701853 -2.326335 -0.340686
C 2.113000 -0.393054 -0.084064
C -3.012585 -0.179775 -0.071118
C 0.771625 -1.060385 -0.174672
C 2.297734 1.004791 0.097364
C 3.271793 -1.217032 -0.186586
C -1.698436 -0.828544 -0.153152
C -0.464276 -0.238856 -0.069687
C 3.588917 1.562983 0.173993
C 4.563253 -0.677256 -0.112434
C -3.184814 1.223884 0.118875
C -4.179439 -0.990772 -0.186262
C 4.722371 0.719173 0.068695
C -4.472339 1.788267 0.190199
C -5.469616 -0.426106 -0.115168
C -5.621726 0.967036 0.073635
H 1.439849 1.678389 0.180781
H 3.117932 -2.291948 -0.325630
H -1.694275 -1.919349 -0.299291
H -0.370682 0.842001 0.074955
H 3.713907 2.644562 0.314014
H 5.455080 -1.305496 -0.190739
H -2.307931 1.874230 0.211035
H -4.062249 -2.071511 -0.332230
H -4.587154 2.868104 0.336449
H -6.352861 -1.067578 -0.206106
H -6.622102 1.410207 0.129668
H 6.052694 2.181734 0.260259


