%chk=000125641.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125641

0 1
 O   -1.651400     -0.3175000     -0.6988000    
 O  -0.4027000       1.648100     -0.8413000    
 O   -4.911800       1.700600      0.7742000    
 O   -2.231700       2.914800      0.9008000    
 O   -4.707700      -1.178500       1.116600    
 O   -3.522400      -3.238800     -0.1585000    
 O   -2.208200      -2.514600      -1.874500    
 O    3.084800      -1.362000      0.4495000    
 O    4.767200      -2.789900       1.063100    
 C   -3.679300      0.9846000      0.8657000    
 C   -2.582300       1.761200      0.1367000    
 C   -3.888500     -0.3982000      0.2475000    
 C   -2.556200      -1.112700      5.8899999E-02
 C   -1.327300      0.9073000     -4.5600001E-02
 C   -2.720500      -2.339200     -0.7790000    
 C   0.9257000       1.404200     -0.6237000    
 C    1.335900      0.1466000     -0.1975000    
 C    1.856800       2.419900     -0.8318000    
 C    2.694100     -7.8100003E-02  1.7400000E-02
 C    3.642700      0.9210000     -0.1837000    
 C    3.216400       2.180100     -0.6123000    
 C    5.042600      0.6176000      5.9700001E-02
 C    5.404700     -0.6010000      0.4684000    
 C    4.418900      -1.675600      0.6882000    
 H   -3.444300      0.9088000       1.934700    
 H   -2.946700       2.117200     -0.8349000    
 H   -4.424500     -0.3033000     -0.7049000    
 H   -2.086200      -1.406800       1.005600    
 H  -0.9032000      0.7108000      0.9509000    
 H   -5.587500       1.177300       1.238400    
 H   -3.043200       3.435000       1.029700    
 H   -4.243600      -1.270800       1.966100    
 H   0.6564000     -0.6828000     -4.0800001E-02
 H    1.532400       3.402100      -1.164800    
 H   -3.644300      -4.051700     -0.6940000    
 H    3.929800       2.983200     -0.7792000    
 H    5.784300       1.393200     -9.5600002E-02
 H    6.447600     -0.8351000      0.6520000    


%chk=000125641-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000125641

0 1
O -1.568539 -0.266978 -0.473478
O -0.376755 1.743984 -0.533249
O -4.966612 1.825176 0.802931
O -2.381747 3.006083 1.120964
O -4.998337 -1.030664 0.924782
O -3.809350 -3.116224 -0.354554
O -1.704430 -2.885694 -1.318440
O 3.248580 -1.281818 0.671877
O 4.934975 -2.742989 1.270647
C -3.764953 0.994320 0.880095
C -2.631797 1.841076 0.279868
C -3.959698 -0.346460 0.158975
C -2.593291 -1.097017 0.167955
C -1.338895 1.016558 0.238154
C -2.595633 -2.421667 -0.596893
C 0.982903 1.392081 -0.430124
C 1.436619 0.160324 0.082968
C 1.888489 2.381794 -0.903221
C 2.827252 -0.057269 0.146790
C 3.768233 0.913263 -0.311784
C 3.264179 2.135510 -0.844588
C 5.173487 0.591360 -0.216509
C 5.600408 -0.613163 0.300938
C 4.668005 -1.629645 0.782039
H -3.526455 0.771103 1.944506
H -2.901550 2.135163 -0.755287
H -4.271667 -0.176242 -0.892664
H -2.331984 -1.318741 1.229956
H -0.957289 0.810684 1.263589
H -5.724681 1.291855 1.155861
H -3.251980 3.467480 1.244056
H -5.093928 -1.950896 0.558133
H 0.753337 -0.639527 0.374772
H 1.483226 3.319119 -1.292372
H -3.791557 -3.994042 -0.823158
H 3.971248 2.891969 -1.202985
H 5.907361 1.327086 -0.566411
H 6.659626 -0.869951 0.379060


