%chk=000158632.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000158632

0 1
 O    5.183700      -1.546700     -0.1795000    
 O    3.506500     -0.7582000      -1.492300    
 C  -0.3366000      0.2538000      0.2110000    
 C   -1.607200     -0.4168000      0.1147000    
 C  -0.2764000       1.656800      4.1999999E-03
 C   -2.769100      0.3417000     -0.1848000    
 C   0.8869000     -0.3992000      0.5039000    
 C    2.098200      0.2927000      0.5874000    
 C   -1.442400       2.369000     -0.2886000    
 C   0.9484000       2.340400      9.1100000E-02
 C   -2.669800       1.721300     -0.3817000    
 C    2.128800       1.663100      0.3807000    
 C   -1.787600      -1.810400      0.3012000    
 C    3.357800     -0.4431000      0.8999000    
 C   -4.024000     -0.2828000     -0.2859000    
 C   -3.041400      -2.418700      0.1979000    
 C   -4.159900      -1.654500     -9.5899999E-02
 C    4.004100     -0.9084000     -0.3832000    
 H   0.9099000      -1.473600      0.6710000    
 H   -1.410400       3.445100     -0.4494000    
 H   0.9936000       3.416400     -6.8200000E-02
 H   -3.552900       2.314600     -0.6118000    
 H    3.061400       2.217200      0.4400000    
 H  -0.9478000      -2.460200      0.5333000    
 H    3.151700      -1.314700       1.531000    
 H    4.058900      0.2060000       1.436300    
 H   -4.914700      0.2994000     -0.5157000    
 H   -3.137700      -3.490100      0.3479000    
 H   -5.136200      -2.122400     -0.1774000    
 H    5.582200      -1.856700      -1.020600    


%chk=000158632-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000158632

0 1
O 4.385219 -1.808943 -0.819023
O 5.098332 0.382077 -0.525150
C -0.343818 0.228945 0.202414
C -1.646796 -0.440603 0.138530
C -0.264902 1.640523 -0.082541
C -2.817351 0.332159 -0.203908
C 0.863842 -0.456173 0.539848
C 2.100331 0.204622 0.600587
C -1.462347 2.375337 -0.422773
C 1.002714 2.298599 -0.025055
C -2.690523 1.746038 -0.480326
C 2.166667 1.601724 0.308056
C -1.817932 -1.835110 0.401261
C 3.370888 -0.558313 0.981801
C -4.094836 -0.306445 -0.267659
C -3.079509 -2.442247 0.332850
C -4.231021 -1.674057 -0.003808
C 4.372091 -0.569641 -0.164223
H 0.838201 -1.528652 0.758668
H -1.373669 3.447301 -0.634843
H 1.049515 3.371078 -0.248193
H -3.594871 2.309614 -0.738534
H 3.135038 2.113153 0.337383
H -0.953603 -2.453790 0.661587
H 3.130386 -1.594820 1.263752
H 3.863918 -0.062025 1.837688
H -4.972455 0.296954 -0.529004
H -3.180778 -3.513444 0.538896
H -5.214229 -2.154088 -0.055447
H 5.019495 -1.768773 -1.586332


