%chk=000119112.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000119112

0 1
 O   -4.848600      0.4007000     -0.4154000    
 O    4.848400      0.4039000      0.4127000    
 O   -3.729300       2.175200      0.7677000    
 O    3.726800       2.178400     -0.7684000    
 O  -0.9205000       2.255600       1.176300    
 O   0.9174000       2.257000      -1.174400    
 C  -0.5996000      -3.261400     -0.4992000    
 C   0.6039000      -3.260600      0.4992000    
 C  -0.6487000      -2.013300      -1.412700    
 C   0.6509000      -2.012900       1.413200    
 C   -1.398100     -0.8479000     -0.7960000    
 C    1.399000     -0.8465000      0.7967000    
 C  -0.7316000      0.1946000     -9.0899996E-02
 C   0.7312000      0.1955000      9.2299998E-02
 C  -0.5726000      -4.509500      -1.399500    
 C   0.5792000      -4.508900       1.399000    
 C   -2.801400     -0.8238000     -0.9286000    
 C    2.802400     -0.8216000      0.9281000    
 C   -1.492100       1.250200      0.4560000    
 C    1.490500       1.251900     -0.4548000    
 C   -3.499700      0.2272000     -0.3751000    
 C    3.499600      0.2301000      0.3744000    
 C   -2.862400       1.237300      0.2978000    
 C    2.861000       1.240100     -0.2976000    
 C   -4.987500       1.638900      0.3105000    
 C    4.985900       1.642300     -0.3133000    
 C  -0.8128000       2.063000       2.585200    
 C   0.8088000       2.064600      -2.583300    
 H   -1.528700      -3.314200      8.4899999E-02
 H    1.533100      -3.311500     -8.5000001E-02
 H   -1.165500      -2.253500      -2.352600    
 H   0.3578000      -1.720500      -1.733700    
 H    1.167800      -2.252400       2.353200    
 H  -0.3562000      -1.721400       1.733900    
 H  -0.7068000      -5.428400     -0.8219000    
 H   -1.389200      -4.483300      -2.129700    
 H   0.3719000      -4.579800      -1.949200    
 H  -0.3651000      -4.581000       1.948800    
 H   0.7148000      -5.427300      0.8212000    
 H    1.395800      -4.481700       2.129200    
 H   -3.325800      -1.614700      -1.456000    
 H    3.327800      -1.612500       1.454700    
 H   -5.467300       2.377000     -0.3424000    
 H   -5.631900       1.465900       1.180000    
 H    5.466600       2.380400      0.3390000    
 H    5.629100       1.469600      -1.183800    
 H   -1.806600       2.017200       3.041500    
 H  -0.2750000       2.916700       3.006400    
 H  -0.2538000       1.150900       2.815700    
 H    1.802300       2.020300      -3.040400    
 H   0.2696000       2.917900      -3.003800    
 H   0.2508000       1.151900      -2.813700    


%chk=000119112-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000119112

0 1
O -4.943499 0.066259 0.203630
O 4.943423 0.071561 -0.203711
O -3.781455 1.838661 1.299643
O 3.779478 1.842844 -1.299512
O -0.662351 1.939038 1.338724
O 0.660256 1.939926 -1.338479
C -0.591148 -3.589092 -0.510088
C 0.595044 -3.588495 0.509636
C -0.745340 -2.266941 -1.338723
C 0.747772 -2.266286 1.338445
C -1.462412 -1.130750 -0.620149
C 1.463630 -1.129239 0.620012
C -0.746706 -0.067658 0.000117
C 0.746781 -0.066848 -0.000134
C -0.457723 -4.771702 -1.503477
C 0.462970 -4.771400 1.502852
C -2.888973 -1.146843 -0.610418
C 2.890207 -1.143813 0.610252
C -1.444672 0.997877 0.663925
C 1.443600 0.999507 -0.663837
C -3.539463 -0.090049 0.018534
C 3.539557 -0.086267 -0.018614
C -2.848564 0.964379 0.647885
C 2.847526 0.967493 -0.647840
C -5.093850 1.441251 0.730464
C 5.092296 1.446778 -0.730376
C -1.231103 3.280022 1.562770
C 1.227689 3.281448 -1.562635
H -1.528502 -3.724794 0.072284
H 1.532549 -3.723062 -0.072757
H -1.332114 -2.518778 -2.243827
H 0.250797 -1.943029 -1.690394
H 1.334805 -2.517601 2.243525
H -0.248721 -1.943499 1.690134
H -0.343746 -5.742846 -0.990968
H -1.349619 -4.841092 -2.153915
H 0.424134 -4.629434 -2.158106
H -0.419028 -4.630236 2.157533
H 0.350075 -5.742595 0.990198
H 1.354958 -4.839887 2.153261
H -3.448538 -1.952876 -1.092014
H 3.450644 -1.949294 1.091757
H -5.347763 2.123232 -0.106162
H -5.844571 1.441615 1.533839
H 5.345471 2.128927 0.106336
H 5.843020 1.448049 -1.533747
H -1.514637 3.745601 0.600150
H -0.419565 3.852429 2.037508
H -2.111932 3.240281 2.224895
H 1.510960 3.747307 -0.600073
H 0.415520 3.853076 -2.037231
H 2.108435 3.242545 -2.224921


