%chk=000089814.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089814

0 1
 O    2.523200      -1.312400      0.5826000    
 O   -2.153600      -1.736400      8.1400000E-02
 O    4.560000     -0.6175000     -0.2572000    
 O   -4.024400      -1.391600      -1.229400    
 O   0.3769000      -2.919100     -0.1554000    
 C    3.154000      0.9194000      0.9549000    
 C   -3.261100      0.3145000      0.2901000    
 C    1.815900       1.404100      0.3929000    
 C    4.279400       1.938800      0.7661000    
 C   -2.416900       1.323600     -0.4915000    
 C   -4.711700      0.7830000      0.4246000    
 C    1.927800       1.955500      -1.027600    
 C    4.358300       2.501600     -0.6528000    
 C   -2.509200       2.722800      0.1111000    
 C   -4.798800       2.183700       1.024800    
 C    3.009400       3.024400      -1.132600    
 C   -3.957300       3.185800      0.2402000    
 C    3.519200     -0.4052000      0.3500000    
 C   -3.216500      -1.022800     -0.3876000    
 C    2.740600      -2.617300      5.9900001E-02
 C   -1.991200      -3.041100     -0.4839000    
 C    1.550600      -3.492500      0.4032000    
 C  -0.7748000      -3.701200      0.1362000    
 H    3.047500      0.7386000       2.032900    
 H   -2.853100      0.2027000       1.304000    
 H    1.051800      0.6189000      0.4152000    
 H    1.441500       2.206500       1.042500    
 H    4.105400       2.775200       1.456000    
 H    5.250100       1.510100       1.043300    
 H   -1.368800       1.002000     -0.5104000    
 H   -2.746200       1.356400      -1.538500    
 H   -5.204100      0.7902000     -0.5567000    
 H   -5.277400      8.0300003E-02   1.048700    
 H   0.9637000       2.378800      -1.332100    
 H    2.149500       1.138100      -1.724300    
 H    5.095300       3.312600     -0.6813000    
 H    4.716500       1.731500      -1.345500    
 H   -2.035100       2.724900       1.100400    
 H   -1.949700       3.429700     -0.5119000    
 H   -5.843700       2.513300       1.041900    
 H   -4.455800       2.155600       2.066400    
 H    3.093700       3.362600      -2.171400    
 H    2.721000       3.897600     -0.5347000    
 H   -3.989400       4.162500      0.7358000    
 H   -4.387900       3.320100     -0.7598000    
 H    3.654200      -3.043500      0.4887000    
 H    2.843200      -2.546200      -1.029300    
 H   -1.846400      -2.937300      -1.565500    
 H   -2.885400      -3.642000     -0.2851000    
 H    1.435100      -3.545900       1.492000    
 H    1.702000      -4.501700      4.6000001E-03
 H  -0.6518000      -4.711600     -0.2691000    
 H  -0.8992000      -3.757800       1.223900    


%chk=000089814-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000089814

0 1
O 2.641060 -1.299834 0.622281
O -2.395757 -1.925725 0.199863
O 4.467102 -0.646436 -0.657518
O -3.709013 -1.346449 -1.636406
O 0.360349 -3.046363 -0.195135
C 3.382150 0.979856 0.894975
C -3.423135 0.245655 0.248085
C 1.924148 1.510060 0.728533
C 4.418164 2.032302 0.424384
C -2.192549 1.173091 -0.010633
C -4.742002 0.950408 -0.150626
C 1.651121 2.007411 -0.710190
C 4.126611 2.554985 -1.003910
C -2.356664 2.520116 0.730443
C -4.894848 2.302961 0.583166
C 2.678079 3.083760 -1.135428
C -3.676480 3.224990 0.337092
C 3.582596 -0.358961 0.183135
C -3.234831 -1.057103 -0.513118
C 2.736087 -2.648502 0.003297
C -2.033719 -3.198331 -0.479015
C 1.568389 -3.473935 0.512950
C -0.830207 -3.778236 0.243186
H 3.537031 0.765532 1.973091
H -3.435720 0.004950 1.329873
H 1.207547 0.720037 1.015106
H 1.792186 2.354841 1.434910
H 4.386770 2.880603 1.138123
H 5.436117 1.602967 0.465835
H -1.267357 0.659160 0.309106
H -2.110224 1.359065 -1.100956
H -4.742261 1.109714 -1.246039
H -5.603858 0.292916 0.072553
H 0.621533 2.409992 -0.773190
H 1.699202 1.151626 -1.414535
H 4.848955 3.354934 -1.257313
H 4.289606 1.733305 -1.726629
H -2.350280 2.339361 1.825487
H -1.489950 3.173375 0.508822
H -5.825478 2.802945 0.252317
H -4.999276 2.122106 1.673548
H 2.484602 3.407487 -2.176490
H 2.552552 3.979766 -0.491190
H -3.789801 4.168801 0.904805
H -3.637332 3.497697 -0.737819
H 3.702743 -3.101797 0.291154
H 2.704976 -2.551885 -1.095921
H -1.806465 -3.000084 -1.540694
H -2.900688 -3.882401 -0.421730
H 1.450958 -3.338958 1.609903
H 1.771322 -4.550969 0.310752
H -0.732896 -4.857949 -0.014492
H -0.964866 -3.690560 1.342902


