%chk=000166371.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000166371

0 1
 O   -3.021200      0.8347000      0.4072000    
 O   -5.075500      0.9603000     -0.6339000    
 C    2.217600      0.3294000     -0.1590000    
 C    3.673300      0.6293000      0.2099000    
 C    1.263100       1.487500      0.1400000    
 C    4.639100     -0.4995000     -0.1571000    
 C  -0.1798000       1.122700     -0.2188000    
 C    6.085500     -0.1175000      0.1660000    
 C   -1.132000       2.291200      5.1800001E-02
 C    7.056800      -1.227600     -0.2346000    
 C   -2.570400       1.962500     -0.3291000    
 C   -4.394400      -2.104500      0.3655000    
 C   -4.645100     -0.7488000       1.043800    
 C    8.497700     -0.8378000      5.4200001E-02
 C   -4.307400      0.4314000      0.1579000    
 C   -2.904100      -2.271500      6.3100003E-02
 C   -5.203200      -2.241700     -0.9270000    
 H    1.889400     -0.5640000      0.3867000    
 H    2.161600      8.5600004E-02  -1.227300    
 H    3.738300      0.8285000       1.286700    
 H    3.984900       1.549000     -0.3011000    
 H    1.573900       2.372500     -0.4282000    
 H    1.323700       1.747300       1.203700    
 H    4.549100     -0.7227000      -1.227100    
 H    4.363900      -1.410200      0.3882000    
 H  -0.2358000      0.8443000      -1.278200    
 H  -0.4863000      0.2452000      0.3629000    
 H    6.347900      0.8064000     -0.3639000    
 H    6.181400      8.7300003E-02   1.239300    
 H  -0.8053000       3.178000     -0.5034000    
 H   -1.091600       2.535400       1.120400    
 H    6.815400      -2.147600      0.3102000    
 H    6.952600      -1.446500      -1.303700    
 H   -3.209300       2.824400     -0.1042000    
 H   -2.630900       1.747700      -1.402700    
 H   -4.703200      -2.896000       1.059100    
 H   -4.080600     -0.6707000       1.981100    
 H   -5.701300     -0.6541000       1.324900    
 H    9.175100      -1.646200     -0.2385000    
 H    8.780600      6.0800001E-02 -0.5034000    
 H    8.644500     -0.6409000       1.121000    
 H   -2.704200      -3.284000     -0.3049000    
 H   -2.301300      -2.123500      0.9653000    
 H   -2.554700      -1.572300     -0.7035000    
 H   -6.268000      -2.067900     -0.7398000    
 H   -5.098200      -3.253300      -1.334200    
 H   -4.871000      -1.541700      -1.700500    


%chk=000166371-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000166371

0 1
O -3.074650 0.984931 0.537879
O -4.992532 0.785774 -0.770137
C 2.228661 0.462748 -0.329665
C 3.683189 0.715984 0.126247
C 1.252461 1.589518 0.076921
C 4.657174 -0.412192 -0.282409
C -0.206932 1.308627 -0.343950
C 6.107645 -0.174622 0.194579
C -1.180656 2.437495 0.060957
C 7.080083 -1.303328 -0.217981
C -2.638112 2.145632 -0.299844
C -4.318551 -2.179958 0.411197
C -4.592281 -0.796983 1.093318
C 8.525101 -1.064727 0.270795
C -4.289087 0.382627 0.187562
C -2.846413 -2.310521 -0.046006
C -5.299529 -2.459833 -0.751008
H 1.873539 -0.498308 0.098151
H 2.205953 0.337815 -1.432606
H 3.704850 0.835891 1.229861
H 4.039667 1.678554 -0.297100
H 1.591059 2.547469 -0.371413
H 1.294469 1.729651 1.177537
H 4.647858 -0.521985 -1.387254
H 4.290778 -1.376904 0.127684
H -0.251337 1.162922 -1.443886
H -0.547693 0.359738 0.114601
H 6.476270 0.790780 -0.211766
H 6.118383 -0.069667 1.299917
H -0.889511 3.381747 -0.443508
H -1.109002 2.622954 1.150680
H 6.707438 -2.268284 0.182896
H 7.073136 -1.403368 -1.322793
H -3.307118 2.996181 -0.073152
H -2.764937 1.878648 -1.365400
H -4.498943 -2.936861 1.202806
H -3.979758 -0.711438 2.007019
H -5.661044 -0.744473 1.371034
H 9.198925 -1.885609 -0.036890
H 8.932402 -0.121385 -0.140033
H 8.562821 -0.992181 1.374298
H -2.642734 -3.335761 -0.405790
H -2.144653 -2.087194 0.778691
H -2.624431 -1.612879 -0.875273
H -6.349584 -2.431279 -0.405456
H -5.108499 -3.458780 -1.185316
H -5.193273 -1.706268 -1.551195


