%chk=000102047.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000102047

0 1
 O  -0.8586000      -1.474500       1.359700    
 O   -1.919500       1.353200     -0.4039000    
 O   -2.663300     -0.3504000       2.242300    
 O   -4.186600       1.749100     -0.3560000    
 C    3.399600      -1.829900      0.9262000    
 C    4.168300      -1.282800     -0.2802000    
 C    2.020600      -1.192100       1.109300    
 C    5.575800      -1.866500     -0.4210000    
 C    1.308900      -1.756500       2.337900    
 C    6.322200      -1.233200      -1.596200    
 C  -8.0899999E-02  -1.158800       2.506200    
 C    7.735200      -1.781000      -1.718700    
 C   -2.137900      -1.007000       1.356800    
 C   -2.841100      -1.403900      0.1108000    
 C   -3.358900     -0.4492000     -0.7647000    
 C   -2.979900      -2.761800     -0.1768000    
 C   -4.015100     -0.8526000      -1.927700    
 C   -3.230800      0.9764000     -0.4920000    
 C   -3.636000      -3.165100      -1.339800    
 C   -4.153700      -2.210600      -2.215100    
 C   -1.662700       2.736000     -0.1365000    
 C  -0.1797000       2.956000     -7.6200001E-02
 C   0.4951000       2.831000       1.138200    
 C   0.5243000       3.285200      -1.234600    
 C    1.873800       3.035300       1.194300    
 C    1.903100       3.489300      -1.178400    
 C    2.577700       3.364400      3.6100000E-02
 H    3.994500      -1.663400       1.833000    
 H    3.287700      -2.915600      0.8160000    
 H    4.239300     -0.1916000     -0.1887000    
 H    3.596400      -1.486500      -1.194000    
 H    1.424600      -1.368900      0.2063000    
 H    2.131100     -0.1069000       1.215500    
 H    5.510900      -2.951900     -0.5623000    
 H    6.136700      -1.693600      0.5055000    
 H    1.220900      -2.844400       2.228300    
 H    1.901500      -1.559900       3.238600    
 H    5.778400      -1.424300      -2.528600    
 H    6.370400     -0.1458000      -1.465300    
 H  -0.5547000      -1.584400       3.398200    
 H  -1.4000000E-02 -7.1000002E-02   2.622300    
 H    8.315800      -1.575100     -0.8138000    
 H    8.249800      -1.316300      -2.565500    
 H    7.723300      -2.863600      -1.880700    
 H   -2.584900      -3.517200      0.4977000    
 H   -4.422000     -0.1193000      -2.619300    
 H   -3.744600      -4.222300      -1.563300    
 H   -4.664500      -2.524600      -3.120600    
 H   -2.127400       3.019500      0.8158000    
 H   -2.106600       3.353500     -0.9270000    
 H  -4.1900001E-02   2.572200       2.046800    
 H   1.0300000E-02   3.382900      -2.187100    
 H    2.399400       2.935700       2.139500    
 H    2.451700       3.744400      -2.080400    
 H    3.651400       3.521800      7.9599999E-02


%chk=000102047-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000102047

0 1
O -0.626094 -1.404279 1.310904
O -2.077005 1.491243 -0.787043
O -2.162785 0.268941 1.834117
O -4.379491 1.760790 -1.068280
C 3.722957 -1.940652 0.845524
C 4.475640 -1.548777 -0.445936
C 2.357531 -1.231771 0.986675
C 5.841633 -2.255459 -0.598386
C 1.599018 -1.637584 2.269652
C 6.587357 -1.869206 -1.896273
C 0.252609 -0.931019 2.427448
C 7.951906 -2.577324 -2.041150
C -1.810389 -0.697152 1.115513
C -2.615571 -1.287636 -0.002951
C -3.435931 -0.479446 -0.841930
C -2.664491 -2.697808 -0.135240
C -4.327547 -1.098462 -1.751384
C -3.384181 1.019907 -0.880113
C -3.537818 -3.305142 -1.062321
C -4.384010 -2.503840 -1.862020
C -1.920206 2.987297 -0.767650
C -0.609403 3.321425 -0.098549
C -0.411188 3.027077 1.275995
C 0.424059 3.961999 -0.824709
C 0.802684 3.372293 1.908192
C 1.638404 4.312452 -0.190465
C 1.829847 4.018977 1.178664
H 4.357366 -1.703959 1.725916
H 3.569404 -3.040356 0.859641
H 4.627543 -0.449231 -0.462202
H 3.839949 -1.786196 -1.324364
H 1.726637 -1.462363 0.106714
H 2.509726 -0.132165 0.983639
H 5.690930 -3.355383 -0.577607
H 6.481499 -2.013483 0.276236
H 1.441339 -2.734072 2.285807
H 2.212257 -1.391123 3.161059
H 5.947644 -2.113067 -2.768999
H 6.735229 -0.770031 -1.917650
H -0.249464 -1.178589 3.381087
H 0.346512 0.167345 2.349250
H 8.620876 -2.324409 -1.196777
H 8.463890 -2.286013 -2.976833
H 7.828085 -3.676870 -2.051599
H -2.024171 -3.308463 0.507525
H -4.964257 -0.460262 -2.372244
H -3.567125 -4.396403 -1.149532
H -5.076614 -2.968386 -2.571646
H -2.793743 3.402523 -0.233518
H -1.950557 3.336268 -1.814979
H -1.200859 2.511562 1.834362
H 0.280252 4.187360 -1.888728
H 0.945333 3.148421 2.971750
H 2.429542 4.810999 -0.761543
H 2.768647 4.292906 1.673451


