%chk=000016033.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000016033

0 1
 O   -1.318100      0.3734000      -1.071800    
 O   -3.184300       2.265400     -2.5300000E-02
 C   -2.275200      4.2900000E-02 -6.6500001E-02
 C   -3.522500      0.9026000     -0.2793000    
 C   -2.595500      -1.448800     -0.1569000    
 C   -4.658800      0.4904000      0.6559000    
 C   -3.725700      -1.846700      0.7851000    
 C   -4.971500     -0.9975000      0.5508000    
 C    4.118700     -0.1075000      0.3561000    
 C   3.0000001E-04  0.2568000     -0.7250000    
 C    2.681800      1.9500000E-02 -2.1100000E-02
 C    5.052300      0.2828000     -0.8316000    
 C    4.468900      -1.571300      0.7677000    
 C    4.579200      0.7836000       1.557400    
 C   0.8250000     -0.6133000      -1.431100    
 C   0.5060000       1.009400      0.3303000    
 C    2.169100     -0.7323000      -1.078000    
 C    1.850200      0.8904000      0.6832000    
 H   -1.884300      0.2604000      0.9365000    
 H   -3.855200      0.8418000      -1.322600    
 H   -1.700900      -2.040400      7.1300000E-02
 H   -2.864900      -1.705900      -1.189900    
 H   -5.554900       1.080700      0.4294000    
 H   -4.393900      0.7425000       1.691200    
 H   -3.393600      -1.731200       1.824200    
 H   -3.969200      -2.905500      0.6429000    
 H   -5.381600      -1.215600     -0.4429000    
 H   -5.743100      -1.265200       1.281300    
 H   -2.450600       2.498800     -0.6196000    
 H    6.108800      0.2172000     -0.5467000    
 H    4.909800     -0.3738000      -1.697000    
 H    4.855300       1.310100      -1.160100    
 H    4.311300      -2.276700     -5.5500001E-02
 H    5.518100      -1.659700       1.072600    
 H    3.845300      -1.899100       1.607900    
 H    5.644000      0.6343000       1.774400    
 H    4.443000       1.849900       1.342100    
 H    4.028600      0.5390000       2.473300    
 H    2.793800      -1.417900      -1.643300    
 H    2.197200       1.501300       1.509200    
 H   0.4294000      -1.201200      -2.254500    
 H  -0.1232000       1.707500      0.8756000    


%chk=000016033-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000016033

0 1
O -1.321444 -0.083808 -1.038205
O -3.399741 1.778308 -1.504121
C -2.413553 0.045628 -0.038070
C -3.637007 0.479644 -0.865124
C -2.676933 -1.280475 0.700887
C -4.879786 0.616719 0.027408
C -3.925818 -1.148871 1.608418
C -5.163185 -0.697451 0.793901
C 4.336059 -0.117502 0.316628
C 0.019971 -0.087822 -0.607632
C 2.817855 -0.101414 0.020008
C 5.041389 0.992035 -0.520708
C 4.925497 -1.506933 -0.073589
C 4.646447 0.136515 1.814222
C 0.981118 -0.306775 -1.624955
C 0.451510 0.120865 0.721946
C 2.350553 -0.311223 -1.309295
C 1.836212 0.113149 1.016772
H -2.161881 0.862790 0.670285
H -3.807402 -0.302857 -1.638979
H -1.791595 -1.579558 1.290827
H -2.844839 -2.072719 -0.055176
H -5.739597 0.905203 -0.603810
H -4.708827 1.447289 0.740532
H -3.727322 -0.409568 2.411839
H -4.124667 -2.116209 2.106962
H -5.435061 -1.496360 0.073982
H -6.033211 -0.561005 1.463422
H -2.542071 1.705118 -1.999045
H 6.131570 0.980400 -0.331160
H 4.885145 0.847296 -1.604732
H 4.652916 1.991951 -0.253894
H 4.766122 -1.731300 -1.143533
H 6.014972 -1.530634 0.119122
H 4.451115 -2.313530 0.514947
H 5.740396 0.120189 1.972694
H 4.274371 1.122937 2.148139
H 4.202682 -0.641839 2.462427
H 3.068188 -0.482459 -2.120082
H 2.138705 0.280165 2.054970
H 0.633611 -0.469942 -2.650101
H -0.263365 0.295151 1.531572


