%chk=000111774.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000111774

0 1
 O    4.448200      -1.312200       0.000000    
 O   -1.702900       2.436300      3.9999999E-04
 C   9.8300003E-02  0.9442000       0.000000    
 C    2.792900      0.3953000       0.000000    
 C   0.7426000      0.8134000      -1.207900    
 C   0.7425000      0.8127000       1.208100    
 C    2.109300      0.5348000      -1.208000    
 C    2.109300      0.5343000       1.208100    
 C   -1.365800       1.242900      3.0000001E-04
 C    4.254200      9.6799999E-02 -1.9999999E-04
 C   -2.374900      0.1960000     -9.9999997E-05
 C   -1.989200      -1.144500      1.9999999E-04
 C   -3.728800      0.5320000     -3.0000001E-04
 C   -2.957200      -2.149000      9.9999997E-05
 C   -4.696700     -0.4724000     -3.0000001E-04
 C   -4.310800      -1.812900     -9.9999997E-05
 C    5.828900      -1.647700     -1.9999999E-04
 H   0.2141000      0.9210000      -2.150100    
 H   0.2139000      0.9199000       2.150300    
 H    2.630000      0.4266000      -2.155800    
 H    2.630000      0.4257000       2.155900    
 H    4.731100      0.5389000     -0.8841000    
 H    4.731400      0.5392000      0.8833000    
 H  -0.9476000      -1.451000      5.0000002E-04
 H   -4.056100       1.568400     -3.9999999E-04
 H   -2.657300      -3.192900      1.9999999E-04
 H   -5.751000     -0.2113000     -3.9999999E-04
 H   -5.064500      -2.595000     -1.9999999E-04
 H    6.319000      -1.257100      0.8970000    
 H    6.318500      -1.257700     -0.8978000    
 H    5.918300      -2.737300      1.9999999E-04


%chk=000111774-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000111774

0 1
O 4.496994 -1.339673 0.000159
O -1.797407 2.532541 0.000423
C 0.046134 0.973671 0.000259
C 2.844260 0.432577 -0.000170
C 0.749064 0.836805 -1.222555
C 0.749391 0.836552 1.222860
C 2.134887 0.571028 -1.218474
C 2.135208 0.570777 1.218355
C -1.430339 1.319158 0.000496
C 4.324773 0.127176 -0.000375
C -2.429283 0.200458 0.000191
C -2.027397 -1.162852 0.000028
C -3.815794 0.521683 0.000057
C -2.998660 -2.187303 -0.000240
C -4.781719 -0.501903 -0.000222
C -4.374685 -1.859850 -0.000371
C 5.911576 -1.713384 0.000093
H 0.214434 0.947187 -2.172618
H 0.215010 0.946740 2.173086
H 2.670336 0.464554 -2.169340
H 2.670916 0.464103 2.169052
H 4.816574 0.556950 -0.901656
H 4.816965 0.557627 0.900372
H -0.961326 -1.414343 0.000122
H -4.100543 1.579383 0.000186
H -2.685781 -3.237084 -0.000352
H -5.848023 -0.250599 -0.000327
H -5.126789 -2.656972 -0.000585
H 6.436767 -1.331333 0.902490
H 6.436488 -1.332069 -0.902778
H 5.937670 -2.814205 0.000535


