%chk=000008955.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000008955

0 1
 O   -5.516100       1.097500      0.7528000    
 O    5.437500      0.2684000      0.9396000    
 C    2.286000      0.2529000      6.4400002E-02
 C    1.460300     -0.9720000     -0.3771000    
 C   2.2700001E-02 -0.9589000      0.1534000    
 C  -0.6941000      0.3347000     -0.3302000    
 C   -2.182200      0.4182000      0.2014000    
 C    1.609900       1.501300     -0.5197000    
 C    3.640900     -0.1122000     -0.5817000    
 C   0.1470000       1.614100     -5.7000000E-02
 C    2.362500      -2.152000     -3.3500001E-02
 C    3.777300      -1.631900     -0.3473000    
 C  -0.7442000      -2.198500     -0.3270000    
 C   -2.883500     -0.9412000      9.9900000E-02
 C    2.422900      0.3937000       1.602800    
 C   -2.946700       1.495100     -0.6397000    
 C   -2.224100      -2.085300     -0.1557000    
 C   -2.211200      0.8310000       1.694700    
 C   -4.389700     -0.9766000      0.2771000    
 C   -4.244200       1.007800      -1.293200    
 C    4.808500      0.6555000     -4.4000000E-02
 C   -5.115600      0.2359000     -0.3124000    
 C    5.176200       1.922500     -0.7676000    
 H    1.387100     -0.9562000      -1.478000    
 H   3.8199998E-02 -0.9812000       1.249000    
 H  -0.7554000      0.2497000      -1.427700    
 H    1.632000       1.469000      -1.616600    
 H    2.146500       2.409000     -0.2229000    
 H    3.601600      5.0099999E-02  -1.667800    
 H   0.1449000       1.854500       1.009900    
 H  -0.3062000       2.474700     -0.5618000    
 H    2.124600      -3.040700     -0.6268000    
 H    2.279100      -2.426800       1.023800    
 H    4.460000      -1.900900      0.4652000    
 H    4.164600      -2.111300      -1.254300    
 H  -0.3921000      -3.075000      0.2304000    
 H  -0.5409000      -2.394600      -1.387100    
 H    2.962800       1.312000       1.861500    
 H    1.456300      0.4468000       2.110500    
 H    2.967500     -0.4421000       2.053600    
 H   -2.317000       1.888400      -1.447000    
 H   -3.177400       2.365600     -1.1300000E-02
 H   -2.780200      -3.016100     -0.2415000    
 H   -1.835100       1.847900       1.845700    
 H   -3.227700      0.8209000       2.102700    
 H   -1.612400      0.1561000       2.315400    
 H   -4.785700      -1.872800     -0.2189000    
 H   -4.616600      -1.084800       1.344900    
 H   -4.790200       1.881500      -1.668900    
 H   -4.008200      0.3776000      -2.159700    
 H   -6.033300     -8.8699996E-02 -0.8160000    
 H    5.346800       1.709200      -1.825700    
 H    4.385800       2.665600     -0.6541000    
 H    6.100200       2.327500     -0.3445000    
 H   -6.125500      0.5973000       1.322100    


%chk=000008955-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000008955

0 1
O -6.144255 0.820393 -0.668855
O 5.623531 0.226841 0.575327
C 2.286070 0.243830 0.051066
C 1.390017 -0.980098 -0.326578
C -0.014677 -0.952910 0.313377
C -0.748221 0.367902 -0.093735
C -2.178174 0.466405 0.557568
C 1.559881 1.521636 -0.433305
C 3.600441 -0.151253 -0.746411
C 0.138832 1.615883 0.184117
C 2.308493 -2.202288 -0.090165
C 3.724572 -1.696933 -0.528831
C -0.825646 -2.203294 -0.106920
C -2.934697 -0.860366 0.347786
C 2.593001 0.324097 1.570798
C -3.037608 1.603924 -0.115451
C -2.318797 -2.039586 0.067686
C -2.095262 0.759085 2.087596
C -4.446722 -0.726414 0.349577
C -3.830464 1.094782 -1.337569
C 4.845989 0.633983 -0.332169
C -4.898884 0.059578 -0.920994
C 5.115642 1.942455 -1.067950
H 1.227799 -0.907043 -1.428591
H 0.089726 -0.973278 1.417673
H -0.905381 0.311761 -1.196624
H 1.480317 1.499851 -1.541300
H 2.128619 2.434248 -0.163544
H 3.396401 0.072277 -1.814158
H 0.236172 1.767613 1.275255
H -0.355842 2.524010 -0.209875
H 1.986731 -3.088063 -0.665952
H 2.303776 -2.489700 0.978664
H 4.489623 -1.898261 0.240916
H 4.059161 -2.188197 -1.460153
H -0.467585 -3.087008 0.459203
H -0.617507 -2.436397 -1.176046
H 3.138177 1.256102 1.808600
H 1.671192 0.315514 2.176151
H 3.228329 -0.512407 1.906971
H -2.388443 2.450838 -0.402955
H -3.759149 2.006494 0.622256
H -2.936468 -2.937395 -0.088334
H -1.759647 1.794849 2.280716
H -3.090206 0.644979 2.556352
H -1.406015 0.067166 2.603044
H -4.937045 -1.717095 0.392943
H -4.786078 -0.143781 1.229551
H -4.345671 1.925048 -1.853512
H -3.140177 0.628644 -2.066852
H -5.070406 -0.656065 -1.753407
H 5.463984 1.718657 -2.095846
H 4.194002 2.543955 -1.167739
H 5.894930 2.522564 -0.549092
H -6.842187 0.194669 -0.346181


