%chk=000134503.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000134503

0 1
 O    4.517000      0.8249000       1.197400    
 O   -4.932000      0.6717000       1.482400    
 C    2.164800      0.3794000      0.6080000    
 C    1.537200     -0.8014000     -0.1704000    
 C   3.0400001E-02 -0.9183000      6.4900003E-02
 C  -0.6524000      0.3851000     -0.4461000    
 C    3.670000      0.1754000      0.2589000    
 C    1.497700       1.684200      0.1303000    
 C    2.435700      -1.981500      0.1866000    
 C  -3.9600000E-02   1.627800      0.2501000    
 C    3.841200      -1.365000      0.3492000    
 C  -0.5983000      -2.123800     -0.6319000    
 C   -2.174700      0.2938000     -0.3660000    
 C    1.978600      0.2815000       2.152300    
 C   -2.080100      -2.219600     -0.2665000    
 C   -2.809700     -0.8951000     -0.2595000    
 C   -2.944800       1.591800     -0.4742000    
 C   -4.314500      -1.017000     -0.1406000    
 C    4.029400      0.6478000      -1.092800    
 C   -4.440500       1.417200     -0.7477000    
 C   -5.036900      0.3087000      0.1073000    
 C    4.321600       1.032400      -2.191700    
 H    1.669800     -0.6303000      -1.250600    
 H  -0.1618000      -1.033300       1.139200    
 H  -0.4235000      0.4906000      -1.518100    
 H    1.732900       1.880000     -0.9222000    
 H    1.879300       2.542300      0.6966000    
 H    2.428400      -2.748200     -0.5951000    
 H    2.120100      -2.459600       1.120600    
 H  -0.3394000       1.652300       1.304200    
 H  -0.4360000       2.546000     -0.1997000    
 H    4.266400      -1.663900       1.315100    
 H    4.518700      -1.752400     -0.4212000    
 H  -9.9100001E-02  -3.054400     -0.3395000    
 H  -0.4886000      -2.031300      -1.720000    
 H    2.425500       1.149800       2.650700    
 H   0.9292000      0.2565000       2.455800    
 H    2.449700     -0.6104000       2.576700    
 H   -2.173200      -2.666200      0.7318000    
 H   -2.565500      -2.906400     -0.9703000    
 H   -2.815900       2.154800      0.4585000    
 H   -2.526500       2.202900      -1.283100    
 H   -4.689300      -1.459900      -1.071900    
 H   -4.550500      -1.708200      0.6780000    
 H    4.305200       1.774200       1.186200    
 H   -4.947100       2.369200     -0.5498000    
 H   -4.593600       1.182600      -1.808700    
 H   -6.103000      0.1877000     -0.1145000    
 H    4.579900       1.373600      -3.166800    
 H   -5.411900       1.508900       1.602200    


%chk=000134503-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000134503

0 1
O 4.642104 0.810200 1.190289
O -5.082336 0.701272 1.435326
C 2.159717 0.382475 0.635037
C 1.537167 -0.810097 -0.159631
C 0.021042 -0.932045 0.069531
C -0.658046 0.382375 -0.421330
C 3.685185 0.191740 0.240526
C 1.477385 1.699342 0.191341
C 2.468763 -2.007619 0.168623
C -0.069265 1.615539 0.328846
C 3.883249 -1.361981 0.343915
C -0.636161 -2.140383 -0.626640
C -2.188644 0.295200 -0.358715
C 2.038329 0.220091 2.173420
C -2.116286 -2.238820 -0.201389
C -2.841988 -0.898141 -0.235037
C -2.959446 1.606599 -0.465502
C -4.356147 -1.009362 -0.113234
C 3.981456 0.689677 -1.122096
C -4.435823 1.407509 -0.866782
C -5.105692 0.326257 0.001151
C 4.276851 1.124831 -2.238058
H 1.679531 -0.575910 -1.239324
H -0.174102 -1.036483 1.158885
H -0.374455 0.511246 -1.494875
H 1.729633 1.903644 -0.868477
H 1.852703 2.556677 0.787329
H 2.458457 -2.765671 -0.633553
H 2.145345 -2.512740 1.098535
H -0.363703 1.569618 1.396082
H -0.505381 2.549172 -0.073414
H 4.315494 -1.569538 1.337986
H 4.603805 -1.717437 -0.410615
H -0.106239 -3.077904 -0.370080
H -0.565186 -2.015751 -1.727005
H 2.624109 1.006142 2.680170
H 0.989433 0.304424 2.502478
H 2.425954 -0.749296 2.529930
H -2.183108 -2.662582 0.824694
H -2.655579 -2.958145 -0.853479
H -2.910384 2.143528 0.504521
H -2.468543 2.268754 -1.207449
H -4.755650 -1.573030 -0.983038
H -4.609577 -1.614318 0.781358
H 4.710971 1.777900 0.983108
H -4.989984 2.365111 -0.785492
H -4.495380 1.086833 -1.926162
H -6.162522 0.186545 -0.315447
H 4.534572 1.492240 -3.214241
H -5.491330 1.599212 1.532086


