%chk=000070184.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000070184

0 1
 O  -0.1419000      -1.668000      0.7899000    
 O  -0.1435000       1.107900      0.8712000    
 O    4.531600       1.167100     -0.1145000    
 O    6.772400       1.182700     -0.5878000    
 C    1.007900     -0.9705000      0.5681000    
 C    1.006200      0.4258000      0.6092000    
 C    3.375400     -0.9669000      6.7400001E-02
 C    3.354900      0.4246000      0.1125000    
 C    2.189300      -1.667200      0.2979000    
 C    2.185100       1.132200      0.3807000    
 C  -0.6003000      -2.512500     -0.2636000    
 C  -0.2768000       2.402100      0.2868000    
 C    4.630700      -1.640400     -0.2180000    
 C   -2.099000      -2.574300     -0.2248000    
 C   -1.732200       2.691700      6.4800002E-02
 C    5.741000     -0.9299000     -0.4315000    
 C    5.744700      0.5441000     -0.3888000    
 C   -2.728400      -3.556600      0.5318000    
 C   -2.845200      -1.649000     -0.9461000    
 C   -2.329500       2.334800      -1.139000    
 C   -2.470600       3.314800       1.064600    
 C   -4.121600      -3.614400      0.5675000    
 C   -4.238400      -1.706600     -0.9104000    
 C   -3.682500       2.604400      -1.345700    
 C   -3.823500       3.584400      0.8582000    
 C   -4.876600      -2.689400     -0.1536000    
 C   -4.429400       3.229200     -0.3471000    
 H    2.186300      -2.754600      0.2753000    
 H    2.236700       2.215200      0.4304000    
 H  -0.1736000      -3.514400     -0.1318000    
 H  -0.2715000      -2.144300      -1.245200    
 H   0.1583000       3.152200      0.9589000    
 H   0.2356000       2.475200     -0.6824000    
 H    4.650700      -2.724000     -0.2544000    
 H    6.681800      -1.425600     -0.6451000    
 H   -2.150100      -4.280900       1.098900    
 H   -2.357700     -0.8801000      -1.538600    
 H   -1.758100       1.844800      -1.922600    
 H   -2.009400       3.593900       2.008000    
 H   -4.618500      -4.379100       1.157300    
 H   -4.826100     -0.9856000      -1.471100    
 H   -4.154500       2.326000      -2.283300    
 H   -4.405400       4.070100       1.636000    
 H   -5.961400      -2.733900     -0.1255000    
 H   -5.482900       3.438300     -0.5076000    


%chk=000070184-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000070184

0 1
O -0.466124 -1.330494 -0.001106
O -0.278004 1.253679 -0.372941
O 4.588731 1.092967 -0.220162
O 6.899592 1.068870 -0.157343
C 0.835800 -0.834058 -0.036611
C 0.935699 0.591794 -0.242935
C 3.290734 -0.979093 0.057097
C 3.362752 0.425488 -0.152215
C 2.003917 -1.593904 0.111627
C 2.199913 1.209913 -0.300628
C -0.637649 -2.768487 0.229544
C -0.248280 2.732387 -0.488004
C 4.531988 -1.701918 0.199876
C -2.123769 -3.082577 0.226900
C -1.678081 3.227177 -0.468857
C 5.751081 -1.057626 0.135520
C 5.863647 0.381229 -0.078931
C -2.542925 -4.424838 0.406667
C -3.093787 -2.067233 0.052470
C -2.080974 4.277043 -1.327550
C -2.614632 2.674595 0.441861
C -3.917289 -4.748808 0.415778
C -4.469572 -2.393961 0.060970
C -3.400086 4.784211 -1.268883
C -3.933782 3.172956 0.492748
C -4.886114 -3.732020 0.244192
C -4.329221 4.233352 -0.357920
H 1.950137 -2.674503 0.274029
H 2.315591 2.283414 -0.463219
H -0.179944 -3.041109 1.204830
H -0.116472 -3.338373 -0.569611
H 0.328718 3.130229 0.373690
H 0.266245 3.027243 -1.423643
H 4.496983 -2.785961 0.362534
H 6.697721 -1.593045 0.241486
H -1.796836 -5.219630 0.537299
H -2.762526 -1.035419 -0.095822
H -1.367265 4.701641 -2.044717
H -2.308721 1.843983 1.086609
H -4.231769 -5.789192 0.554800
H -5.214648 -1.602445 -0.078159
H -3.700906 5.598923 -1.936539
H -4.653754 2.738338 1.195201
H -5.952919 -3.982393 0.251397
H -5.353198 4.620955 -0.314430


