%chk=000041643.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041643

0 1
 O   -4.608300      0.4352000     -7.2800003E-02
 O   -2.927600       1.881400      0.3943000    
 C    4.167600     -1.5799999E-02  0.2140000    
 C    3.208700       1.163100     -4.3099999E-02
 C   -2.347000     -0.3714000     -0.3612000    
 C    1.756300      0.7612000     -0.1262000    
 C  -0.9115000      2.4800001E-02 -0.2792000    
 C   -2.741200      -1.613300      0.4867000    
 C    1.216600      0.4144000      -1.354600    
 C   0.9880000      0.7471000       1.027400    
 C  -0.1259000      4.3900002E-02  -1.431600    
 C  -0.3546000      0.3765000      0.9504000    
 C    4.155800     -0.9647000     -0.9870000    
 C    3.800800     -0.7876000       1.484100    
 C   -3.295000      0.7732000      2.6400000E-02
 C   -1.982600      -2.867900      7.2300002E-02
 H    5.180400      0.3902000      0.3276000    
 H    3.498300       1.687700     -0.9634000    
 H    3.328600       1.905200      0.7578000    
 H   -2.590800     -0.5939000      -1.410000    
 H   -2.571500      -1.423200       1.553600    
 H   -3.812200      -1.823300      0.3797000    
 H    1.815900      0.4320000      -2.260300    
 H    1.408300       1.024700       1.989600    
 H  -0.5441000     -0.2262000      -2.397700    
 H  -0.9498000      0.3698000       1.859500    
 H    4.954200      -1.708300     -0.8813000    
 H    3.216700      -1.519000      -1.077800    
 H    4.336700     -0.4241000      -1.921900    
 H    2.862100      -1.341700       1.385700    
 H    3.725000     -0.1144000       2.344300    
 H    4.581600      -1.522200       1.712300    
 H   -2.133300      -3.083900     -0.9902000    
 H  -0.9087000      -2.768800      0.2570000    
 H   -2.339800      -3.729000      0.6464000    
 H   -5.196400       1.177700      0.1821000    


%chk=000041643-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000041643

0 1
O -4.032236 1.355220 -0.733488
O -3.602131 0.869694 1.493372
C 4.188279 0.016590 0.190319
C 3.183218 1.183618 -0.106003
C -2.507560 -0.473462 -0.286978
C 1.715612 0.782521 -0.155981
C -1.044209 -0.007551 -0.240333
C -2.734530 -1.803892 0.495410
C 1.101741 0.388789 -1.373141
C 0.911190 0.788101 1.014953
C -0.255927 0.001401 -1.416217
C -0.443798 0.398060 0.979097
C 4.172713 -1.063326 -0.916508
C 3.960797 -0.614611 1.583315
C -3.408559 0.616136 0.282809
C -1.953041 -2.986043 -0.110886
H 5.196017 0.484473 0.191740
H 3.473201 1.641402 -1.072292
H 3.326011 1.957881 0.673581
H -2.795040 -0.619965 -1.343364
H -2.443799 -1.647927 1.550528
H -3.818111 -2.033984 0.497589
H 1.691825 0.393204 -2.297709
H 1.353443 1.111599 1.965151
H -0.707143 -0.292252 -2.371862
H -1.045763 0.427454 1.894967
H 4.939812 -1.835269 -0.719376
H 3.189785 -1.566928 -0.965033
H 4.380296 -0.624676 -1.911217
H 2.972044 -1.105443 1.639825
H 4.009272 0.147147 2.384573
H 4.731685 -1.378886 1.794910
H -2.259547 -3.174636 -1.157314
H -0.865870 -2.791465 -0.106978
H -2.136964 -3.910574 0.465646
H -4.581415 2.077002 -0.320205


