%chk=000097996.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097996

0 1
 O    4.178600      0.3499000     -0.4441000    
 C   -1.612200      -1.173200     -8.3300002E-02
 C   -3.085400     -0.7326000      0.1364000    
 C  -0.6223000     -2.6600000E-02  0.2302000    
 C   -3.366200      0.6429000     -0.4416000    
 C   -2.475600       1.680200      0.2255000    
 C   -1.030100       1.257200      0.3936000    
 C   -1.435300      -1.621500      -1.552400    
 C   -1.392600      -2.400100      0.8353000    
 C   0.7777000     -0.4095000      0.3124000    
 C  -0.1425000       2.426300      0.7531000    
 C    1.816300      0.2749000     -0.1755000    
 C    1.750700       1.585000     -0.9131000    
 C    3.212100     -0.2724000      1.1000000E-03
 C    3.426700      -1.580600      0.7225000    
 H   -3.314100     -0.7119000       1.211200    
 H   -3.774400      -1.461600     -0.3088000    
 H   -4.418300      0.9079000     -0.2852000    
 H   -3.201700      0.6461000      -1.525100    
 H   -2.881000       1.917500       1.217600    
 H   -2.524900       2.602100     -0.3672000    
 H   -2.173200      -2.384800      -1.824600    
 H  -0.4431000      -2.056100      -1.722200    
 H   -1.546300     -0.7847000      -2.250500    
 H   -1.356700      -2.107300       1.891100    
 H  -0.4698000      -2.940300      0.5976000    
 H   -2.209200      -3.123700      0.7209000    
 H   0.9520000      -1.338100      0.8422000    
 H  -7.1999999E-03   3.133100     -6.9300003E-02
 H   0.7781000       2.160400       1.275200    
 H  -0.6735000       3.009500       1.520900    
 H    2.116300       2.429500     -0.3235000    
 H   0.7999000       1.769600      -1.417000    
 H    2.441800       1.527800      -1.767100    
 H    3.083700      -1.505100       1.757600    
 H    2.920600      -2.393700      0.1958000    
 H    4.497400      -1.808400      0.7398000    


%chk=000097996-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000097996

0 1
O 4.231035 0.181209 -0.668228
C -1.624913 -1.135397 -0.136796
C -3.107882 -0.715576 0.084751
C -0.652905 0.020878 0.238086
C -3.404897 0.706544 -0.422702
C -2.552643 1.712990 0.370615
C -1.091472 1.300590 0.505759
C -1.399979 -1.525355 -1.629061
C -1.360713 -2.393008 0.744502
C 0.774327 -0.364486 0.333644
C -0.197174 2.411180 1.024916
C 1.857114 0.205826 -0.301315
C 1.765641 1.341929 -1.297533
C 3.239351 -0.329103 -0.059062
C 3.469094 -1.479402 0.925884
H -3.337858 -0.760336 1.169627
H -3.762138 -1.457339 -0.413968
H -4.479944 0.943577 -0.311941
H -3.168665 0.782510 -1.501659
H -2.980056 1.849200 1.388137
H -2.592212 2.716739 -0.101007
H -2.011197 -2.409937 -1.891971
H -0.339317 -1.772067 -1.818308
H -1.676758 -0.699820 -2.309347
H -1.362563 -2.137631 1.820634
H -0.400761 -2.883537 0.501783
H -2.160585 -3.137322 0.570842
H 0.974765 -1.252925 0.948609
H -0.008066 3.173707 0.242572
H 0.778099 2.043201 1.380445
H -0.699513 2.937598 1.860444
H 2.096218 2.297752 -0.847812
H 0.733113 1.469914 -1.661952
H 2.446246 1.151508 -2.144890
H 3.143511 -1.208381 1.946743
H 2.914511 -2.387900 0.626361
H 4.545487 -1.709630 0.942699


