%chk=000083873.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000083873

0 1
 O   0.5794000      -3.533400     -0.6231000    
 O   -3.689200      -2.456300       2.272100    
 O    3.255700      -1.265200       1.734500    
 O    5.203500     -0.2912000       1.084000    
 C  -7.0400000E-02 -0.1665000      -1.812300    
 C    1.265500     -0.5692000      -2.443400    
 C  -0.3177000      -1.272600     -0.7766000    
 C    1.276300      -2.098900      -2.441100    
 C   0.1248000      -2.535800      -1.524600    
 C   0.1649000       1.229800      -1.242800    
 C    2.329100      5.4499999E-02  -1.532500    
 C    1.644200       1.270900     -0.9783000    
 C   -1.738500      -1.339800     -0.3174000    
 C    2.269300       2.265600     -0.3392000    
 C   -2.113200      -1.246200      0.9667000    
 C    3.748500       2.303200     -8.6700000E-02
 C   -3.543300      -1.315700       1.423900    
 C    4.054600       2.307800       1.414300    
 C   -3.972300     -8.3499998E-02   2.232100    
 C   -3.776800       1.233400       1.475100    
 C    3.504800       1.074400       2.125200    
 C   -4.633500       1.339100      0.2092000    
 C    4.093400     -0.2080000       1.593100    
 C   -4.388900       2.621800     -0.5869000    
 C   -5.270100       2.681700      -1.825500    
 H  -0.8727000     -0.1527000      -2.561500    
 H    1.364300     -0.1685000      -3.459800    
 H   0.3332000      -1.133400      9.8399997E-02
 H    2.246000      -2.508700      -2.137900    
 H    1.079100      -2.467400      -3.455100    
 H  -0.6920000      -2.959700      -2.121800    
 H  -8.7300003E-02   1.983400      -1.997700    
 H  -0.4280000       1.416600     -0.3424000    
 H    2.605700     -0.6292000     -0.7270000    
 H    3.221100      0.2935000      -2.119500    
 H   -2.501600      -1.470200      -1.081400    
 H    1.687000       3.110700      2.0500001E-02
 H   0.8891000      -4.287200      -1.153800    
 H   -1.355500      -1.120900       1.736700    
 H    4.140600       3.229900     -0.5240000    
 H    4.288500       1.492700     -0.5827000    
 H   -4.226200      -1.465300      0.5809000    
 H    3.628300       3.206100       1.878300    
 H    5.141100       2.367600       1.552900    
 H   -5.022600     -0.1938000       2.530800    
 H   -3.404800     -4.3400001E-02   3.171500    
 H   -2.719900       1.379100       1.224200    
 H   -4.044600       2.058300       2.147400    
 H    2.413400       1.033300       2.043700    
 H    3.750000       1.127300       3.192000    
 H   -3.456000      -3.243800       1.751000    
 H   -5.692700       1.278700      0.4888000    
 H   -4.433000      0.4901000     -0.4529000    
 H   -3.336300       2.675900     -0.8883000    
 H   -4.592000       3.494300      4.4500001E-02
 H   -5.081100       3.606200      -2.380000    
 H   -6.330400       2.658700      -1.554400    
 H   -5.066800       1.838000      -2.492800    
 H    3.646000      -2.091900       1.379000    


%chk=000083873-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000083873

0 1
O 1.508725 -2.808526 -0.196264
O -3.507937 -2.200739 2.554248
O 2.238453 -1.194050 1.704330
O 4.349699 -1.164069 0.747662
C 0.043637 0.038275 -1.830710
C 1.269033 -0.463639 -2.653868
C -0.116344 -1.014616 -0.677096
C 1.177283 -2.006379 -2.585772
C 0.518972 -2.340392 -1.215672
C 0.455959 1.442990 -1.325025
C 2.509283 0.173347 -1.949655
C 1.965870 1.323336 -1.088809
C -1.541620 -1.171976 -0.200219
C 2.689009 2.077579 -0.218125
C -1.965922 -0.977537 1.076660
C 4.175507 1.923423 0.042576
C -3.402638 -1.135226 1.520487
C 4.542913 1.703092 1.542058
C -3.978261 0.121996 2.202085
C -4.021283 1.381331 1.306271
C 3.666855 0.657479 2.278959
C -4.972342 1.280533 0.090032
C 3.487586 -0.640073 1.504575
C -5.063255 2.600298 -0.709348
C -6.006044 2.505002 -1.928507
H -0.879249 0.069456 -2.441728
H 1.210646 -0.109399 -3.699803
H 0.505097 -0.679382 0.174187
H 2.158401 -2.503356 -2.713003
H 0.517911 -2.378321 -3.393689
H -0.234420 -3.146429 -1.309754
H 0.245726 2.195144 -2.113735
H -0.096553 1.756474 -0.420119
H 3.037968 -0.567718 -1.321119
H 3.249251 0.529823 -2.691218
H -2.283784 -1.452208 -0.968567
H 2.166869 2.852599 0.365774
H 2.111388 -3.490528 -0.578678
H -1.244835 -0.706506 1.862726
H 4.716611 2.829172 -0.303650
H 4.570820 1.074730 -0.542030
H -4.025324 -1.414552 0.642664
H 4.453656 2.659065 2.095402
H 5.605286 1.399446 1.590579
H -4.997376 -0.126804 2.557775
H -3.365253 0.321611 3.102594
H -2.997519 1.616195 0.948578
H -4.337590 2.241486 1.931085
H 2.662844 1.058377 2.495295
H 4.132380 0.415030 3.255378
H -3.018342 -2.998372 2.226437
H -5.986208 0.991399 0.438466
H -4.634389 0.472598 -0.590918
H -4.046645 2.890261 -1.046345
H -5.408439 3.410297 -0.034539
H -6.048892 3.459313 -2.485238
H -7.036021 2.250931 -1.613953
H -5.668026 1.718826 -2.630277
H 2.030872 -1.945913 1.027953


