%chk=000127848.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127848

0 1
 O   -3.791900      -3.007400     -0.4336000    
 O   -4.755100       3.071400      -1.132400    
 O    6.030700       1.506700     -0.9737000    
 O   -4.814200       2.220700      0.9779000    
 C   -1.361300     -0.2766000     -0.2044000    
 C   -1.691200      -1.780500     -4.3800000E-02
 C  -1.7400000E-02  6.9600001E-02  0.4711000    
 C    1.117300     -0.7589000     -0.2218000    
 C   -2.666500      0.4313000      0.2219000    
 C    2.556300     -0.4505000      0.3495000    
 C  -0.6233000      -2.589600     -0.7891000    
 C   -3.077500      -1.817600     -0.7065000    
 C   0.7880000      -2.276800     -0.2693000    
 C   -3.785400     -0.5837000     -0.1313000    
 C   0.3077000       1.565600      0.4075000    
 C   -1.783500      -2.271200       1.424700    
 C    2.773600       1.065000      0.3999000    
 C    1.666700       1.880800       1.018300    
 C    3.608400      -1.107500     -0.5920000    
 C   -2.925900       1.756500     -0.4919000    
 C    2.744100      -1.011100       1.777800    
 C    5.021200     -0.5837000     -0.3881000    
 C    3.882200       1.683300     -3.9999999E-02
 C    5.048300      0.9147000     -0.5319000    
 C   -4.251000       2.349500     -9.8700002E-02
 H   -1.232100     -6.7800000E-02  -1.279500    
 H  -6.9700003E-02 -0.2005000       1.531300    
 H    1.124600     -0.4264000      -1.272900    
 H   -2.664300      0.5944000       1.307300    
 H  -0.6575000      -2.359700      -1.862100    
 H  -0.8191000      -3.664800     -0.6988000    
 H   -2.988100      -1.717600      -1.795700    
 H   0.9050000      -2.721800      0.7236000    
 H    1.500800      -2.793800     -0.9212000    
 H   -4.363700     -0.8393000      0.7651000    
 H   -4.508800     -0.2076000     -0.8636000    
 H  -0.4433000       2.131900      0.9679000    
 H   0.2788000       1.915900     -0.6320000    
 H  -0.8391000      -2.174800       1.966300    
 H   -2.533500      -1.723100       2.003100    
 H   -2.057600      -3.331900       1.460700    
 H    1.638100       1.681300       2.096800    
 H    1.856700       2.956100      0.9127000    
 H    3.327400     -0.9240000      -1.638600    
 H    3.620800      -2.196100     -0.4606000    
 H   -2.162300       2.503200     -0.2670000    
 H   -2.920200       1.591800      -1.576700    
 H    3.681900     -0.6632000       2.226600    
 H    1.937300     -0.7065000       2.451700    
 H    2.778300      -2.105700       1.781200    
 H    5.678700      -1.018200      -1.149100    
 H    5.416900     -0.8506000      0.5969000    
 H   -4.682500      -2.906000     -0.8104000    
 H    3.992800       2.761800      2.4999999E-03
 H   -5.621800       3.473100     -0.9093000    


%chk=000127848-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000127848

0 1
O -3.750414 -3.192452 -0.426601
O -4.591139 3.449449 -0.986211
O 6.133972 1.555188 -0.942552
O -4.748454 2.322638 1.036129
C -1.388529 -0.323571 -0.216397
C -1.694046 -1.848460 -0.059734
C -0.048785 0.061546 0.461145
C 1.101561 -0.750292 -0.230462
C -2.719664 0.395610 0.189609
C 2.545463 -0.437288 0.353862
C -0.600554 -2.634900 -0.815539
C -3.101864 -1.903900 -0.702260
C 0.812916 -2.280497 -0.283697
C -3.838164 -0.672606 -0.100689
C 0.253232 1.574826 0.384912
C -1.789840 -2.315503 1.418021
C 2.754081 1.086539 0.384032
C 1.637656 1.916543 0.984949
C 3.612498 -1.100607 -0.573569
C -2.976107 1.704383 -0.588529
C 2.707539 -0.973075 1.813489
C 5.044308 -0.564502 -0.366534
C 3.903053 1.690166 -0.062258
C 5.100849 0.954666 -0.513012
C -4.175565 2.472668 -0.065466
H -1.247655 -0.145007 -1.309814
H -0.104918 -0.218117 1.533986
H 1.121533 -0.387179 -1.285380
H -2.709709 0.635265 1.270027
H -0.661037 -2.386434 -1.896197
H -0.771901 -3.724515 -0.725195
H -2.992993 -1.775958 -1.804239
H 0.937104 -2.719988 0.723757
H 1.562875 -2.773371 -0.929515
H -4.345801 -0.977064 0.831335
H -4.615510 -0.279466 -0.783237
H -0.519254 2.146779 0.933564
H 0.223055 1.903849 -0.674832
H -0.804671 -2.327935 1.913556
H -2.454293 -1.668258 2.017511
H -2.206851 -3.336092 1.447071
H 1.597764 1.722050 2.078193
H 1.858954 2.992847 0.865347
H 3.320175 -0.922326 -1.628558
H 3.609229 -2.195015 -0.418459
H -2.110407 2.391316 -0.534005
H -3.132461 1.505374 -1.665666
H 3.677235 -0.658227 2.238485
H 1.913870 -0.598748 2.483611
H 2.675375 -2.076245 1.833146
H 5.753863 -1.017377 -1.081352
H 5.412313 -0.819038 0.648813
H -4.635452 -3.210344 -0.868819
H 3.995367 2.784373 -0.050551
H -5.355001 3.958383 -0.598919


