%chk=000036336.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000036336

0 1
 O  -0.1709000       2.082300      0.3626000    
 O   -2.387100      0.5946000     -0.6659000    
 O    2.204700      0.9143000     -0.4171000    
 O   -1.220600      -1.917800     -0.2355000    
 O    1.543500      -1.661800      0.2963000    
 C   -1.443700       2.655800      6.7599997E-02
 C   0.9177000       2.886100     -9.4700001E-02
 C   -2.500200       1.595800      0.3467000    
 C    2.204500       2.161900      0.2738000    
 C   -3.182500     -0.5649000     -0.4202000    
 C    3.202800      9.8000001E-03  5.5000000E-02
 C   -2.426300      -1.567900      0.4429000    
 C    2.775100      -1.387200     -0.3706000    
 C  -0.4640000      -2.907600      0.4646000    
 C   0.9470000      -2.893300     -0.1054000    
 H   -1.479100       2.959700     -0.9848000    
 H   -1.596400       3.527800      0.7113000    
 H   0.8800000       3.868900      0.3864000    
 H   0.8453000       3.000400      -1.182000    
 H   -2.341700       1.152800       1.335300    
 H   -3.501000       2.036800      0.2956000    
 H    3.081600       2.743700     -2.5900001E-02
 H    2.227500       1.987100       1.355500    
 H   -3.382300      -1.013400      -1.399300    
 H   -4.143300     -0.2909000      2.9500000E-02
 H    3.270400      5.5700000E-02   1.148000    
 H    4.167600      0.2785000     -0.3856000    
 H   -2.172100      -1.131100       1.413900    
 H   -3.036600      -2.464300      0.5968000    
 H    2.617700      -1.421000      -1.454400    
 H    3.524600      -2.129400     -7.8400001E-02
 H  -0.9338000      -3.884100      0.3103000    
 H  -0.4400000      -2.672800       1.535100    
 H    1.536000      -3.723600      0.2967000    
 H   0.9156000      -2.952500      -1.199100    


%chk=000036336-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000036336

0 1
O -0.447803 2.154802 0.534538
O -2.856926 0.896286 -0.869371
O 2.098463 0.858425 -0.327507
O -1.601240 -2.507646 -0.090977
O 1.479949 -1.930823 0.430726
C -1.676061 2.816833 0.087092
C 0.762248 2.836207 0.072062
C -2.836659 1.840142 0.255755
C 1.971585 2.035183 0.532880
C -2.848641 -0.526293 -0.510442
C 3.053609 -0.133997 0.170908
C -1.462255 -1.035517 -0.079299
C 2.632475 -1.498213 -0.359620
C -0.544544 -3.246525 0.595854
C 0.832250 -3.146959 -0.071279
H -1.604198 3.100736 -0.984828
H -1.853208 3.738530 0.688480
H 0.814796 3.864074 0.499640
H 0.765588 2.913672 -1.036550
H -2.741801 1.316152 1.227930
H -3.793233 2.402407 0.246888
H 2.885846 2.668184 0.465481
H 1.827854 1.730152 1.591656
H -3.147567 -1.053862 -1.432234
H -3.600740 -0.746669 0.276197
H 3.048699 -0.166009 1.281263
H 4.081668 0.114468 -0.174356
H -0.683819 -0.698395 -0.788477
H -1.169571 -0.677497 0.928176
H 2.362433 -1.413742 -1.434501
H 3.472127 -2.223549 -0.259654
H -0.893067 -4.294697 0.580367
H -0.445878 -2.912138 1.651790
H 1.449936 -4.039037 0.181972
H 0.707683 -3.106287 -1.175560


