%chk=000126751.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126751

0 1
 O   -2.021300       1.668500     -6.6999998E-03
 O  -0.3111000       2.571400      -1.161400    
 C   7.9300001E-02  0.4353000     -1.0200000E-02
 C    1.499500      0.3898000     -0.6925000    
 C  -0.7323000     -0.8172000     -0.4836000    
 C    2.254400     -0.9591000     -0.4859000    
 C    2.430800       1.607500     -0.4495000    
 C    3.246100     -0.9830000      0.6890000    
 C   -2.124000     -0.8090000      0.1660000    
 C   1.6400000E-02  -2.128000     -0.3506000    
 C    1.358100      -2.161900     -0.3699000    
 C    3.415300       1.498900      0.7096000    
 C   0.1943000      0.5453000       1.524400    
 C  -0.7456000       1.647000     -0.4851000    
 C    4.195300      0.2009000      0.6638000    
 C   -2.842900      0.4957000     -0.1685000    
 C  -0.7670000      -3.410500     -0.3005000    
 C   -4.084300      0.6785000      0.6947000    
 C   -5.060800     -0.4699000      0.5169000    
 H    1.274400      0.4346000      -1.771700    
 H  -0.9089000     -0.7082000      -1.566700    
 H    2.855300      -1.110500      -1.395300    
 H    1.867300       2.535500     -0.3272000    
 H    3.024900       1.745300      -1.364100    
 H    3.841000      -1.905300      0.6514000    
 H    2.719100      -1.004900       1.649500    
 H   -2.721600      -1.645200     -0.2143000    
 H   -2.041700     -0.9531000       1.249500    
 H    1.862000      -3.125400     -0.3182000    
 H    2.894900       1.580700       1.668600    
 H    4.113600       2.343300      0.6680000    
 H   0.7521000       1.439300       1.815300    
 H  -0.7794000      0.6550000       2.013400    
 H   0.6730000     -0.3295000       1.968700    
 H    4.815000      0.1658000     -0.2403000    
 H    4.876100      0.1478000       1.520900    
 H   -3.146700      0.4787000      -1.223500    
 H  -0.1194000      -4.293600     -0.3305000    
 H   -1.445000      -3.476900      -1.157600    
 H   -1.352300      -3.469100      0.6225000    
 H   -4.575400       1.621800      0.4252000    
 H   -3.806600      0.7788000       1.751100    
 H   -5.292100     -0.6383000     -0.5398000    
 H   -4.679400      -1.401400      0.9457000    
 H   -5.999700     -0.2405000       1.031700    


%chk=000126751-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000126751

0 1
O -2.081212 1.658270 -0.110296
O -0.177856 2.843998 0.091874
C 0.119072 0.381567 0.177501
C 1.455431 0.386157 -0.676171
C -0.730870 -0.825199 -0.369193
C 2.270494 -0.943706 -0.489347
C 2.418832 1.612739 -0.620662
C 3.346146 -0.913084 0.644122
C -2.145275 -0.829792 0.249962
C 0.031458 -2.152895 -0.271617
C 1.389543 -2.167276 -0.346822
C 3.458641 1.613288 0.524043
C 0.351136 0.268219 1.718423
C -0.679793 1.702271 0.015621
C 4.281964 0.307783 0.526701
C -2.904590 0.406518 -0.240384
C -0.762239 -3.442896 -0.167982
C -4.220186 0.710702 0.492108
C -5.299277 -0.370045 0.259132
H 1.083003 0.361346 -1.724108
H -0.881060 -0.630789 -1.458285
H 2.854031 -1.059190 -1.432452
H 1.834645 2.545593 -0.604869
H 2.986662 1.601074 -1.576136
H 3.930253 -1.854260 0.592460
H 2.857802 -0.901253 1.636022
H -2.706496 -1.724070 -0.072892
H -2.104928 -0.852762 1.355122
H 1.915029 -3.133269 -0.297541
H 2.962204 1.740644 1.505545
H 4.127092 2.487252 0.398077
H 1.046239 1.050711 2.059894
H -0.591894 0.400839 2.278456
H 0.763265 -0.720615 1.975310
H 4.862209 0.241009 -0.417719
H 5.015392 0.306941 1.356352
H -3.100813 0.304776 -1.328926
H -0.089182 -4.317623 -0.177754
H -1.471814 -3.555742 -1.012523
H -1.363016 -3.489715 0.761182
H -4.586357 1.691717 0.137406
H -4.011456 0.820056 1.573706
H -5.501717 -0.508407 -0.819970
H -5.001115 -1.348476 0.677721
H -6.248696 -0.077506 0.741210


