%chk=000003745.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000003745

0 1
 O   0.5897000      0.3292000      0.1660000    
 O   -4.124600      0.6640000      0.6167000    
 O   0.4004000      -3.702300     -0.3908000    
 C  -0.7625000      -1.681100     -7.7000000E-03
 C  -0.6259000     -0.3064000      0.1779000    
 C   -4.376400       1.702900     -0.3282000    
 C   -3.020200     -0.1052000      0.4117000    
 C   -1.755900      0.4842000      0.3884000    
 C    1.729900     -0.4300000     -4.8300002E-02
 C   -2.026500      -2.275100      1.5200000E-02
 C   0.4458000      -2.491100     -0.2257000    
 C   -3.154900      -1.481800      0.2255000    
 C    1.728800      -1.759700     -0.2330000    
 C    2.982500      0.3520000     -3.6200002E-02
 C   -4.346100       3.046300      0.3847000    
 C   -5.715100       1.450500      -1.004900    
 C    4.172200     -0.2349000      0.4021000    
 C    2.983600       1.682400     -0.4630000    
 C    5.355400      0.5037000      0.4138000    
 C    4.166900       2.421000     -0.4513000    
 C    5.352700       1.831600     -1.2900000E-02
 H   -3.611900       1.716400      -1.117000    
 H   -1.640000       1.553500      0.5422000    
 H   -2.150800      -3.344700     -0.1276000    
 H   -4.139200      -1.942300      0.2430000    
 H    2.620400      -2.349100     -0.4127000    
 H   -4.539400       3.869400     -0.3100000    
 H   -3.374700       3.214800      0.8602000    
 H   -5.095400       3.080100       1.183300    
 H   -5.945000       2.229200      -1.738400    
 H   -5.708700      0.4812000      -1.515000    
 H   -6.524600       1.412500     -0.2678000    
 H    4.212000      -1.259200      0.7630000    
 H    2.075900       2.164500     -0.8176000    
 H    6.278000      4.6900000E-02  0.7599000    
 H    4.165600       3.454500     -0.7851000    
 H    6.273800       2.407000     -3.0000000E-03


%chk=000003745-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000003745

0 1
O 0.560934 0.204393 -0.076339
O -4.302647 0.382311 -0.351629
O 0.462633 -3.902100 0.711581
C -0.757388 -1.852659 0.262630
C -0.678292 -0.463343 -0.002132
C -4.324108 1.855780 -0.608449
C -3.089103 -0.271020 -0.147045
C -1.816897 0.343208 -0.206721
C 1.751948 -0.521971 0.113295
C -2.052320 -2.438592 0.319598
C 0.476798 -2.647151 0.469637
C -3.201584 -1.669903 0.120135
C 1.720490 -1.875266 0.373880
C 2.949757 0.339088 -0.002348
C -4.143691 2.621833 0.713412
C -5.677214 2.117082 -1.275761
C 4.257872 -0.210390 0.107603
C 2.813563 1.737303 -0.227317
C 5.393461 0.615326 -0.002049
C 3.953210 2.560535 -0.336664
C 5.248488 2.005573 -0.224516
H -3.505542 2.094836 -1.318307
H -1.676225 1.407830 -0.404737
H -2.110182 -3.512442 0.524083
H -4.202188 -2.109398 0.157632
H 2.650812 -2.426766 0.523900
H -4.153903 3.710972 0.525306
H -3.193224 2.368208 1.213240
H -4.970720 2.380587 1.403884
H -5.781830 3.189937 -1.517702
H -5.771489 1.534052 -2.207305
H -6.500222 1.827699 -0.599359
H 4.395378 -1.283256 0.275031
H 1.812229 2.166634 -0.314419
H 6.392766 0.175277 0.084379
H 3.830661 3.635370 -0.509226
H 6.133573 2.645323 -0.309801


