%chk=000137354.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000137354

0 1
 O  -0.2349000      -1.730600     -0.9287000    
 O    2.098600       1.591300     -4.4199999E-02
 O    3.229400     -0.3729000     -0.7107000    
 O  -0.4287000       1.249300      -1.376400    
 O  -0.8773000      -1.215500       1.299900    
 O   0.9428000      -3.925500      0.3341000    
 O   -3.067400     -0.1433000       1.696700    
 O   -4.789000      0.6082000      -1.436300    
 O    4.429500       2.328700       1.287300    
 O    4.708200      7.0900001E-02   1.430000    
 O   -6.821800       1.259300      0.3723000    
 C    1.269200      0.4432000      0.1092000    
 C    1.830100     -0.4834000     -0.9363000    
 C  -0.2214000      0.6252000     -0.1118000    
 C  -0.8901000     -0.7770000     -6.2899999E-02
 C    1.195500      -1.857600     -0.8351000    
 C    3.382400       1.016900     -0.3575000    
 C   -2.350600     -0.7171000     -0.5215000    
 C    1.623100      -2.684400      0.3737000    
 C   -3.175800      0.2545000      0.3274000    
 C    4.026700       1.788900      -1.495300    
 C   -4.666100      0.2952000     -4.6799999E-02
 C    4.240800       1.052300      0.8718000    
 C   -5.452800       1.323300      0.7610000    
 H    1.448300      6.8499997E-02   1.125500    
 H    1.638800     -8.8200003E-02  -1.944400    
 H  -0.6111000       1.295900      0.6615000    
 H    1.492000      -2.434700      -1.720200    
 H   -2.785300      -1.723000     -0.4374000    
 H   -2.406100     -0.4532000      -1.584400    
 H    1.383100      -2.201500       1.323100    
 H    2.700900      -2.875000      0.3484000    
 H   -2.774300       1.268600      0.2345000    
 H   5.2999999E-02   2.094000      -1.367000    
 H    4.108300       2.857300      -1.269500    
 H    5.024500       1.399600      -1.724500    
 H    3.426500       1.699400      -2.407800    
 H   -1.538700      -1.920300       1.399400    
 H   -5.114100     -0.6954000      9.9699996E-02
 H    1.239800      -4.440600       1.103500    
 H   -3.498700      -1.009800       1.790800    
 H   -5.103700       2.338900      0.5499000    
 H   -5.388800       1.142000       1.837900    
 H   -5.738200      0.6286000      -1.647000    
 H    4.988700       2.373300       2.092000    
 H   -7.145200      0.3675000      0.5860000    


%chk=000137354-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000137354

0 1
O -0.297742 -1.681850 -0.956244
O 2.117316 1.660096 -0.171740
O 3.222167 -0.302479 -0.993239
O -0.564181 1.363073 -1.437991
O -0.813406 -1.090046 1.315341
O 0.599235 -3.286338 1.035308
O -3.342213 -0.285215 1.753327
O -4.820671 0.680304 -1.487533
O 5.114761 1.796431 1.199010
O 3.777734 -0.004336 1.789729
O -7.053755 1.054231 0.167443
C 1.236570 0.474638 0.017054
C 1.748728 -0.448496 -1.089367
C -0.253438 0.740222 -0.154785
C -0.941785 -0.668803 -0.094836
C 1.185169 -1.860280 -0.895802
C 3.456618 1.061351 -0.438253
C -2.408948 -0.661214 -0.542419
C 1.726222 -2.579552 0.375174
C -3.317626 0.197195 0.364288
C 4.214154 1.936178 -1.418102
C -4.777017 0.156083 -0.117126
C 4.117612 0.859292 0.951713
C -5.702502 0.992892 0.781388
H 1.411508 0.054850 1.021839
H 1.405347 -0.070917 -2.070417
H -0.642769 1.341703 0.689847
H 1.367267 -2.490776 -1.779888
H -2.760404 -1.710248 -0.532355
H -2.474604 -0.275025 -1.572185
H 2.194199 -1.869693 1.081056
H 2.488656 -3.315396 0.061002
H -2.978664 1.255994 0.328556
H -0.067881 2.219718 -1.487433
H 4.350129 2.949322 -1.008039
H 5.207276 1.504832 -1.623919
H 3.643825 1.990309 -2.359569
H -0.463872 -2.050546 1.323448
H -5.121906 -0.904276 -0.102730
H 0.946777 -3.851701 1.768122
H -2.423706 -0.649278 1.938409
H -5.367530 2.043474 0.804320
H -5.728114 0.586303 1.807512
H -5.762465 0.965042 -1.640414
H 5.473362 1.669831 2.119861
H -7.519330 0.194899 0.330538


