%chk=000061051.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000061051

0 1
 O   2.0000000E-02 -0.6016000     -6.5600000E-02
 O   -1.222700      -2.545800     -0.1810000    
 C    3.746300      -1.150300     -0.1174000    
 C    2.415100     -0.4033000     -5.5900000E-02
 C    4.919000     -0.2089000     -1.6899999E-02
 C    1.232800      -1.360600     -0.1122000    
 C    5.459600      0.3330000      -1.173800    
 C    5.439800      0.1007000       1.230900    
 C    6.545200       1.204000      -1.080800    
 C    6.525300      0.9718000       1.324000    
 C    7.078000       1.523400      0.1681000    
 C   -1.127700      -1.330800     -0.1083000    
 C   -4.727600     -1.2900000E-02 -6.3000000E-03
 C   -2.263100     -0.3823000     -5.2099999E-02
 C   -3.533900     -0.8421000     -6.7100003E-02
 C   -4.655200       1.339300     -0.3407000    
 C   -5.944700     -0.5701000      0.3858000    
 C   -5.799900       2.134400     -0.2831000    
 C   -7.089400      0.2248000      0.4433000    
 C   -7.017000       1.577100      0.1089000    
 H    3.801700      -1.890200      0.6916000    
 H    3.813900      -1.724500      -1.050500    
 H    2.339600      0.3173000     -0.8807000    
 H    2.350000      0.1958000      0.8617000    
 H    1.260500      -1.939300      -1.042900    
 H    1.262600      -2.047200      0.7420000    
 H    5.050500      9.1899998E-02  -2.150800    
 H    5.015300     -0.3221000       2.137100    
 H    6.975200       1.633900      -1.980700    
 H    6.939900       1.221000       2.296400    
 H    7.923100       2.201800      0.2405000    
 H   -2.019500      0.6715000      2.2000000E-02
 H   -3.711800      -1.914300     -0.1163000    
 H   -3.734700       1.812000     -0.6707000    
 H   -6.020600      -1.621800      0.6514000    
 H   -5.745200       3.186400     -0.5478000    
 H   -8.037300     -0.2088000      0.7486000    
 H   -7.908500       2.195800      0.1527000    


%chk=000061051-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000061051

0 1
O 0.057617 -0.541452 0.003018
O -1.225444 -2.498520 -0.021981
C 3.826187 -1.213554 -0.012671
C 2.481557 -0.432230 -0.004240
C 5.028583 -0.280131 -0.010433
C 1.285385 -1.384150 -0.008148
C 5.585332 0.189881 -1.227896
C 5.591290 0.176245 1.209484
C 6.671790 1.093711 -1.228493
C 6.677757 1.080042 1.214903
C 7.221594 1.543485 -0.005579
C -1.161767 -1.241301 -0.005465
C -4.809223 0.061694 0.012947
C -2.290323 -0.290728 0.007683
C -3.581406 -0.744324 0.001308
C -4.806259 1.487728 0.036115
C -6.065254 -0.611093 0.000939
C -6.015536 2.208246 0.046373
C -7.276879 0.110622 0.011104
C -7.256862 1.524287 0.033901
H 3.860048 -1.878478 0.872946
H 3.855149 -1.867893 -0.906309
H 2.429931 0.230673 -0.887930
H 2.433954 0.218388 0.888766
H 1.264827 -2.028061 -0.907876
H 1.270772 -2.042604 0.881146
H 5.167243 -0.158774 -2.180896
H 5.177840 -0.183093 2.160540
H 7.091209 1.443067 -2.178984
H 7.101832 1.418742 2.167180
H 8.065810 2.242116 -0.003738
H -2.027287 0.771342 0.022390
H -3.712140 -1.836809 -0.014157
H -3.855739 2.032185 0.046418
H -6.082026 -1.707733 -0.016558
H -5.996984 3.303556 0.064209
H -8.232314 -0.425026 0.001428
H -8.195662 2.088948 0.041959


