%chk=000227434.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227434

0 1
 O  -0.1838000      -1.293500       2.137900    
 O   0.5968000     -0.3525000      -2.343100    
 O  -0.3124000      -2.880500      0.5221000    
 O   -1.315200      -1.533500      -2.114300    
 C   -1.640400      0.2343000      0.2442000    
 C  -0.3519000     -0.5159000     -0.1162000    
 C   -1.737300       1.502100     -0.6180000    
 C   -2.852800     -0.6994000      0.1151000    
 C   0.8458000      0.4412000      0.1194000    
 C   -3.095300       2.195300     -0.7017000    
 C   -3.985000     -0.3373000       1.077700    
 C   -3.913700       2.190600      0.5842000    
 C   -4.760600      0.9292000      0.7357000    
 C    2.233800     -0.2009000     -2.8500000E-02
 C  -0.3038000      -1.701200      0.8482000    
 C  -0.4154000     -0.8746000      -1.604800    
 C    3.342200      0.8106000      0.2805000    
 C    4.752700      0.2410000      0.1032000    
 C    5.858700       1.226800      0.4820000    
 C    7.237700      0.6182000      0.2765000    
 H   -1.581600      0.5646000       1.291200    
 H   -1.413300       1.343400      -1.651600    
 H   -1.049000       2.249200     -0.2009000    
 H   -2.613100      -1.745100      0.3257000    
 H   -3.253100     -0.6832000     -0.9057000    
 H   0.7812000      0.8680000       1.130100    
 H   0.8217000       1.298000     -0.5652000    
 H   -2.918600       3.236900      -1.000400    
 H   -3.680700       1.751800      -1.516900    
 H   -4.700400      -1.169700       1.095700    
 H   -3.589400     -0.2596000       2.098100    
 H   -3.278800       2.349500       1.463000    
 H   -4.604700       3.042300      0.5430000    
 H   -5.342600      0.7632000     -0.1795000    
 H   -5.494300       1.100300       1.533500    
 H    2.409000     -0.6153000      -1.023400    
 H    2.327000      -1.038600      0.6730000    
 H    3.226400       1.167700       1.311300    
 H    3.229900       1.684700     -0.3728000    
 H    4.883800     -6.9600001E-02 -0.9408000    
 H    4.852500     -0.6632000      0.7167000    
 H  -0.1247000      -2.052000       2.757000    
 H   0.5123000     -0.5809000      -3.293200    
 H    5.770000       2.134800     -0.1255000    
 H    5.747100       1.525000       1.530800    
 H    7.391100      0.3383000     -0.7707000    
 H    7.367900     -0.2761000      0.8943000    
 H    8.014300       1.338100      0.5529000    


%chk=000227434-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000227434

0 1
O -0.476220 -1.427436 2.046652
O 0.407419 -0.156028 -2.500109
O 0.296242 -2.824271 0.372059
O -1.094828 -1.860572 -2.088786
C -1.697656 0.273851 0.161967
C -0.327847 -0.465082 -0.178245
C -1.819732 1.609110 -0.632369
C -2.936834 -0.659980 0.031007
C 0.892205 0.473591 0.124842
C -3.237435 2.235020 -0.685690
C -4.026499 -0.354974 1.091638
C -4.032554 2.231298 0.647230
C -4.852032 0.934121 0.863974
C 2.283700 -0.196369 0.073553
C -0.154305 -1.711105 0.707468
C -0.384838 -0.937666 -1.641106
C 3.422248 0.835389 0.240042
C 4.827044 0.191948 0.234123
C 5.971147 1.221182 0.379973
C 7.371092 0.569834 0.374861
H -1.601263 0.522738 1.236458
H -1.472353 1.463460 -1.675069
H -1.128716 2.347864 -0.181484
H -2.621846 -1.712744 0.158669
H -3.363315 -0.606561 -0.989010
H 0.728777 0.906520 1.131373
H 0.871787 1.301398 -0.604081
H -3.122011 3.276924 -1.045684
H -3.847338 1.715991 -1.452070
H -4.731126 -1.210138 1.131992
H -3.536711 -0.309814 2.086497
H -3.346954 2.401509 1.503296
H -4.738773 3.085221 0.643448
H -5.503864 0.792048 -0.023449
H -5.531807 1.070956 1.729631
H 2.407470 -0.723319 -0.891702
H 2.373546 -0.964176 0.867926
H 3.279534 1.395141 1.188719
H 3.358229 1.584020 -0.577037
H 4.965410 -0.377300 -0.708720
H 4.895691 -0.550370 1.056710
H -0.287333 -2.237548 2.593690
H 0.284910 -0.495852 -3.428894
H 5.902451 1.960145 -0.444499
H 5.830469 1.791601 1.320980
H 7.545851 0.014886 -0.566314
H 7.477374 -0.147852 1.210264
H 8.171593 1.325892 0.475078


