%chk=000045286.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000045286

0 1
 O  -0.6471000     -0.5237000     -8.9800000E-02
 O   0.5567000       1.453400     -0.4928000    
 O   -3.367200     -0.7078000      0.7970000    
 O   -4.823300      0.8102000     -0.1583000    
 C   0.5701000      2.2299999E-02 -0.6242000    
 C    1.743700     -0.5448000      0.1645000    
 C   -1.503700      0.6079000      8.7499999E-02
 C  -0.5341000       1.724800      0.3886000    
 C    3.071900      3.2299999E-02 -0.3210000    
 C   0.6744000     -0.3300000      -2.102600    
 C    4.244400     -0.5144000      0.4951000    
 C   -2.505400      0.3489000       1.192400    
 C    5.578000      3.5399999E-02 -1.0200000E-02
 C    6.748500     -0.5317000      0.7771000    
 C   -4.499300     -0.3353000      0.1245000    
 C   -5.307500      -1.547300     -0.2276000    
 H    1.616600     -0.3057000       1.228400    
 H    1.751000      -1.640100      9.8899998E-02
 H   -2.007400      0.7773000     -0.8721000    
 H  -0.1572000       1.686300       1.416800    
 H  -0.9456000       2.718500      0.1931000    
 H    3.241800     -0.2246000      -1.371900    
 H    3.065200       1.126100     -0.2480000    
 H  -0.2479000     -4.4500001E-02  -2.622900    
 H    1.485700      0.2032000      -2.606800    
 H   0.7953000      -1.408400      -2.249700    
 H    4.253600      -1.609700      0.4351000    
 H    4.113700     -0.2498000       1.551500    
 H   -3.066300       1.253300       1.455100    
 H   -1.992900      8.5000005E-03   2.099100    
 H    5.584600       1.128600      7.0500001E-02
 H    5.706500     -0.2125000      -1.070400    
 H    6.789800      -1.622000      0.6882000    
 H    7.691800     -0.1243000      0.4001000    
 H    6.667900     -0.2760000       1.838500    
 H   -5.606700      -2.070500      0.6840000    
 H   -4.723800      -2.205600     -0.8760000    
 H   -6.209000      -1.238900     -0.7646000    


%chk=000045286-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000045286

0 1
O -0.619472 -0.532656 -0.157395
O 0.497883 1.532361 -0.551710
O -3.483236 -0.821857 0.866542
O -4.841086 0.840281 -0.050209
C 0.619771 0.051634 -0.746587
C 1.801248 -0.506014 0.063778
C -1.574448 0.576990 0.068655
C -0.632394 1.763930 0.363183
C 3.186407 -0.027520 -0.422604
C 0.673707 -0.202474 -2.254464
C 4.328806 -0.495428 0.506523
C -2.490508 0.221122 1.235243
C 5.726520 -0.049267 0.019819
C 6.866450 -0.515333 0.951070
C -4.632950 -0.368669 0.203145
C -5.527884 -1.533850 -0.151440
H 1.651185 -0.207635 1.119621
H 1.744717 -1.611909 0.032320
H -2.165670 0.769971 -0.847713
H -0.296613 1.755648 1.421573
H -1.064298 2.744995 0.110464
H 3.379825 -0.403937 -1.447176
H 3.185080 1.078928 -0.482285
H -0.279093 0.099246 -2.720472
H 1.485639 0.385642 -2.714205
H 0.847031 -1.273326 -2.457737
H 4.308047 -1.602514 0.591708
H 4.155671 -0.102137 1.530139
H -3.032521 1.122446 1.576216
H -1.911059 -0.231489 2.054389
H 5.745167 1.056303 -0.066609
H 5.898297 -0.443335 -1.002785
H 6.888312 -1.618925 1.029009
H 7.853988 -0.183238 0.581187
H 6.734475 -0.110523 1.972329
H -5.595444 -2.242551 0.689624
H -5.097656 -2.079993 -1.010374
H -6.527093 -1.165517 -0.425673


