%chk=000086050.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086050

0 1
 O   -3.490000     -0.1691000       1.030600    
 O   -1.927100     -0.9039000     -0.5975000    
 C   -3.758400      0.5055000      -1.294800    
 C   -3.286400     -0.5767000     -0.3244000    
 C   -3.109600       1.851600     -0.9848000    
 C   -3.280700       2.194500      0.4898000    
 C   -2.813200       1.041600       1.366700    
 C   3.3199999E-02  -2.191300      3.6200002E-02
 C   0.9090000     -0.9458000      0.1998000    
 C   -1.444700      -1.908500      0.2828000    
 C    2.378700      -1.259900     -8.8500001E-02
 C    3.260200     -2.4599999E-02  0.1042000    
 C    4.723500     -0.3294000     -0.2157000    
 C    5.559900      0.8692000     -6.3699998E-02
 C    6.245700       1.846900      5.9500001E-02
 H   -3.531000      0.2215000      -2.328300    
 H   -4.845800      0.6178000      -1.204100    
 H   -3.893500      -1.474600     -0.4904000    
 H   -2.041400       1.812400      -1.230700    
 H   -3.554300       2.635400      -1.607800    
 H   -4.343100       2.385900      0.6842000    
 H   -2.729400       3.108200      0.7352000    
 H   -3.033500       1.262500       2.416000    
 H   -1.729700      0.8995000       1.285900    
 H   0.1523000      -2.568000     -0.9873000    
 H   0.3708000      -2.980100      0.7182000    
 H   0.8061000     -0.5604000       1.221400    
 H   0.5689000     -0.1551000     -0.4795000    
 H   -2.017000      -2.830400      0.1253000    
 H   -1.567700      -1.605400       1.328400    
 H    2.721600      -2.061600      0.5769000    
 H    2.479300      -1.627600      -1.116900    
 H    3.172100      0.3345000       1.137600    
 H    2.901100      0.7863000     -0.5428000    
 H    4.809400     -0.7048000      -1.242100    
 H    5.091700      -1.120400      0.4478000    
 H    6.853800       2.714200      0.1689000    


%chk=000086050-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000086050

0 1
O -3.466981 -0.035536 1.193152
O -1.994880 -0.935731 -0.509751
C -3.859234 0.408581 -1.231255
C -3.368203 -0.582731 -0.165363
C -3.145573 1.774802 -1.098390
C -3.287152 2.308776 0.347368
C -2.762184 1.261882 1.345020
C 0.017761 -2.233384 -0.088999
C 0.913540 -1.019310 0.243293
C -1.446833 -2.035530 0.312854
C 2.384469 -1.226784 -0.178931
C 3.284069 -0.019452 0.164065
C 4.757521 -0.242616 -0.279387
C 5.643623 0.892041 0.037480
C 6.377385 1.846940 0.307142
H -3.693069 -0.034187 -2.229572
H -4.949362 0.540842 -1.092278
H -3.997779 -1.494419 -0.112417
H -2.073313 1.649602 -1.342549
H -3.568351 2.495233 -1.822839
H -4.351932 2.521047 0.567070
H -2.723650 3.253423 0.475943
H -2.949610 1.551863 2.391964
H -1.673900 1.104090 1.197651
H 0.063077 -2.443991 -1.175887
H 0.401751 -3.135187 0.431018
H 0.868250 -0.818931 1.334643
H 0.501746 -0.124095 -0.261504
H -2.039724 -2.956943 0.123017
H -1.539691 -1.774751 1.386622
H 2.786505 -2.137358 0.314204
H 2.427152 -1.419349 -1.271646
H 3.260083 0.171840 1.254500
H 2.893373 0.893097 -0.326424
H 4.784210 -0.432541 -1.371337
H 5.149921 -1.158670 0.206622
H 7.017784 2.677336 0.541002


