%chk=000127588.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127588

0 1
 O   -5.062300     -0.1967000       1.042600    
 O    5.099200      0.4951000       1.054700    
 C   -1.168100     -0.5169000     -0.4620000    
 C   0.3009000     -0.4459000      4.2399999E-02
 C    1.063900      0.8085000     -0.4128000    
 C   -1.881700      0.8088000     -0.2116000    
 C   0.2918000       2.069000     -7.6000001E-03
 C   -1.863000      -1.668100      0.3122000    
 C   -1.123400       2.064200     -0.5778000    
 C   -1.191800     -0.8297000      -1.973500    
 C    2.471500      0.8269000      0.1829000    
 C   -3.376800      -1.656200      0.1681000    
 C   -3.124400      0.8984000      0.2906000    
 C   -3.935300     -0.3124000      0.5644000    
 C    3.267100     -0.3987000     -0.2460000    
 C    4.677900     -0.3936000      0.3160000    
 C    5.554500      -1.552600     -8.2599998E-02
 H   0.8055000      -1.356200     -0.2988000    
 H   0.3140000     -0.4760000       1.141200    
 H    1.158000      0.7961000      -1.506000    
 H   0.8198000       2.961500     -0.3647000    
 H   0.2447000       2.145400       1.086700    
 H   -1.628400      -1.585500       1.383000    
 H   -1.471300      -2.640300     -1.2600000E-02
 H   -1.076500       2.143800      -1.670900    
 H   -1.647200       2.961200     -0.2256000    
 H    2.421000      0.8730000       1.278400    
 H    2.995300       1.735300     -0.1413000    
 H  -0.7161000      -1.794800      -2.182100    
 H   -2.215100     -0.8756000      -2.362300    
 H  -0.6634000     -7.3200002E-02  -2.562700    
 H   -3.805500      -2.418300      0.8283000    
 H   -3.690700      -1.878400     -0.8565000    
 H   -3.602400       1.856100      0.4680000    
 H    2.812400      -1.322400      0.1222000    
 H    3.336000     -0.4443000      -1.338200    
 H    5.669800      -1.568000      -1.169100    
 H    5.106100      -2.487300      0.2631000    
 H    6.541300      -1.443600      0.3758000    


%chk=000127588-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000127588

0 1
O -5.279644 -0.120731 0.895068
O 5.358734 0.841949 0.419706
C -1.227795 -0.527918 -0.445552
C 0.241866 -0.484450 0.093925
C 1.071130 0.744489 -0.350551
C -1.915402 0.822705 -0.194802
C 0.322614 2.034675 0.060899
C -1.983743 -1.664854 0.303946
C -1.114703 2.072444 -0.517832
C -1.216695 -0.815891 -1.980666
C 2.501895 0.735808 0.242824
C -3.512637 -1.623752 0.106261
C -3.207972 0.911952 0.257971
C -4.089740 -0.254431 0.472301
C 3.376815 -0.443193 -0.225564
C 4.870593 -0.267769 0.078459
C 5.739179 -1.514537 -0.052621
H 0.741651 -1.424945 -0.213202
H 0.209751 -0.487385 1.204478
H 1.164019 0.737693 -1.458979
H 0.881770 2.926415 -0.282554
H 0.276185 2.089091 1.167925
H -1.767898 -1.573401 1.387427
H -1.582949 -2.644953 -0.021726
H -1.038300 2.168753 -1.622605
H -1.655474 2.968443 -0.162238
H 2.442075 0.730620 1.350077
H 3.019860 1.675883 -0.027303
H -0.691917 -1.769179 -2.180133
H -2.242163 -0.897502 -2.382358
H -0.701096 -0.020893 -2.547327
H -4.023912 -2.393384 0.711014
H -3.778577 -1.827570 -0.951229
H -3.665826 1.891648 0.448244
H 3.044920 -1.408768 0.205208
H 3.288763 -0.569045 -1.328012
H 5.445871 -2.124055 -0.926701
H 5.603688 -2.148824 0.845728
H 6.802361 -1.236538 -0.123605


