%chk=000109372.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000109372

0 1
 O   -3.753400     -0.8089000      0.1134000    
 C    2.865200      0.4429000      0.7430000    
 C    1.359600      0.7964000      0.7293000    
 C   0.7621000       1.049000     -0.6623000    
 C  -0.7526000       1.359200     -0.6800000    
 C    3.135300     -0.8848000      7.4000000E-03
 C   -1.585200      0.1679000     -0.1739000    
 C    3.720100       1.590700      0.1988000    
 C   -1.071800       2.648600      8.1400000E-02
 C    4.584400      -1.362500      0.1383000    
 C   -3.086700      0.3516000     -0.3673000    
 C    4.798000      -2.687200     -0.5786000    
 C   -5.162000     -0.7010000     -3.8500000E-02
 C   -5.812800      -1.961800      0.4891000    
 H    3.142000      0.3040000       1.797100    
 H    1.211000       1.684000       1.355800    
 H   0.8192000     -2.1100000E-02   1.220100    
 H    1.288700       1.885000      -1.137900    
 H   0.9297000      0.1751000      -1.301800    
 H   -1.019600       1.530000      -1.732000    
 H    2.466800      -1.658800      0.4050000    
 H    2.902700     -0.7794000      -1.058700    
 H   -1.274000     -0.7492000     -0.6908000    
 H   -1.394600     -1.4200000E-02  0.8907000    
 H    4.776800       1.447400      0.4450000    
 H    3.636900       1.676000     -0.8894000    
 H    3.415600       2.545700      0.6403000    
 H  -0.3837000       3.450900     -0.2059000    
 H   -2.084000       2.999400     -0.1432000    
 H  -0.9982000       2.507400       1.164400    
 H    4.844400      -1.477400       1.196800    
 H    5.272900     -0.6275000     -0.2911000    
 H   -3.445500       1.221200      0.1929000    
 H   -3.314100      0.4930000      -1.430200    
 H    5.837900      -3.011900     -0.4729000    
 H    4.154500      -3.467800     -0.1604000    
 H    4.577600      -2.595500      -1.647000    
 H   -5.412000     -0.5725000      -1.097600    
 H   -5.530500      0.1658000      0.5217000    
 H   -6.900600      -1.912500      0.3872000    
 H   -5.446800      -2.840300     -5.2400000E-02
 H   -5.563300      -2.111900       1.544700    


%chk=000109372-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000109372

0 1
O -3.812677 -0.807679 0.119657
C 2.894319 0.449241 0.718943
C 1.368480 0.767544 0.718113
C 0.748784 1.005017 -0.680625
C -0.765024 1.373019 -0.684969
C 3.214179 -0.852308 -0.067267
C -1.633878 0.222214 -0.108552
C 3.736595 1.651635 0.223289
C -1.035669 2.724904 0.023596
C 4.631536 -1.420144 0.179693
C -3.137203 0.414916 -0.335305
C 4.876882 -2.747586 -0.570732
C -5.272853 -0.728582 -0.018380
C -5.857144 -2.047292 0.488311
H 3.173868 0.265097 1.780108
H 1.200235 1.663157 1.350210
H 0.840851 -0.072979 1.212574
H 1.300090 1.820740 -1.190917
H 0.886685 0.094821 -1.298201
H -1.049915 1.497148 -1.753753
H 2.469769 -1.629004 0.209793
H 3.086442 -0.671427 -1.154560
H -1.341265 -0.734771 -0.584080
H -1.453511 0.108750 0.977470
H 4.817683 1.475061 0.368075
H 3.571452 1.842529 -0.853850
H 3.471239 2.573377 0.774926
H -0.335885 3.503392 -0.334543
H -2.062530 3.086950 -0.167574
H -0.913255 2.637512 1.119239
H 4.775281 -1.577290 1.268648
H 5.394001 -0.679253 -0.132473
H -3.525157 1.289465 0.233400
H -3.350283 0.586903 -1.416561
H 5.894739 -3.137493 -0.384893
H 4.153896 -3.522449 -0.252475
H 4.761050 -2.611628 -1.662877
H -5.543101 -0.557545 -1.085411
H -5.661882 0.132207 0.572090
H -6.959512 -2.041738 0.406439
H -5.464260 -2.893512 -0.101398
H -5.583054 -2.207921 1.545321


