%chk=000176096.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000176096

0 1
 O    4.209400      0.4927000      -1.055900    
 O    1.234600      -2.103300       1.654600    
 O   -2.209500      -1.522900      -1.854100    
 O    3.509400      -1.932300      8.4700003E-02
 O   -4.489800      -1.457000     -0.2669000    
 C   0.3117000       2.637600      0.9522000    
 C  -0.7999000       2.809400     -0.1021000    
 C    1.167000       1.415900      0.7204000    
 C   -1.773200       1.680600     -0.1487000    
 C   0.8017000      0.2112000       1.300000    
 C    2.302100       1.520600     -6.8000004E-02
 C   -1.539300      0.5917000     -0.9887000    
 C   -2.917300       1.713400      0.6489000    
 C    3.092800      0.3914000     -0.2818000    
 C    1.592300     -0.9182000       1.086100    
 C    2.737900     -0.8279000      0.2954000    
 C   -2.449700     -0.4642000      -1.031500    
 C   -3.827800      0.6575000      0.6058000    
 C   -3.594000     -0.4314000     -0.2345000    
 C    4.053100      0.2539000      -2.453200    
 C   4.9600001E-02  -2.109800       2.448400    
 C   -1.461200      -2.609100      -1.311200    
 H  -0.1289000       2.590400       1.956900    
 H   0.9467000       3.533100      0.9521000    
 H  -0.3490000       2.943700      -1.094600    
 H   -1.335000       3.746500      0.1002000    
 H  -9.2399999E-02  0.2037000       1.913200    
 H    2.579600       2.469100     -0.5200000    
 H  -0.6545000      0.5616000      -1.620100    
 H   -3.109300       2.554700       1.309600    
 H   -4.714600      0.6954000       1.232800    
 H    3.108200      -2.681500      0.5585000    
 H    3.364600      0.9831000      -2.891800    
 H    3.688200     -0.7624000      -2.632500    
 H    5.030200      0.3639000      -2.931100    
 H   0.1509000      -1.467200       3.329600    
 H  -8.6599998E-02  -3.132500       2.815100    
 H  -0.8375000      -1.865800       1.854000    
 H   -5.216300      -1.262600      0.3499000    
 H   -1.949800      -3.009900     -0.4176000    
 H  -0.4433000      -2.287000      -1.071300    
 H   -1.408500      -3.399300      -2.065000    


%chk=000176096-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000176096

0 1
O 4.578865 1.116656 -0.872770
O 1.601744 -2.037963 1.303240
O -2.834525 -1.490695 -1.920556
O 3.922283 -1.596349 0.131358
O -4.728972 -1.516167 0.258090
C 0.219071 2.802001 0.714744
C -0.928021 2.809346 -0.354518
C 1.197781 1.646661 0.564929
C -1.931931 1.677481 -0.191640
C 0.868199 0.353500 1.054511
C 2.433024 1.835566 -0.091173
C -1.950396 0.575324 -1.078679
C -2.860247 1.686288 0.880889
C 3.356765 0.774027 -0.272237
C 1.778337 -0.700395 0.870854
C 3.031726 -0.511355 0.225039
C -2.859354 -0.496899 -0.926480
C -3.776521 0.626813 1.049871
C -3.793722 -0.462077 0.147939
C 5.194423 0.158205 -1.813408
C 0.347109 -2.369913 1.977273
C -2.814369 -2.901270 -1.484801
H -0.242824 2.784312 1.721305
H 0.766551 3.759956 0.631014
H -0.470310 2.770880 -1.360057
H -1.452431 3.782497 -0.274099
H -0.090052 0.192121 1.555889
H 2.719296 2.818521 -0.479614
H -1.246329 0.518782 -1.915389
H -2.875723 2.527942 1.583374
H -4.502247 0.654593 1.874585
H 3.477799 -2.377620 0.559148
H 4.503116 -0.058777 -2.650722
H 5.467565 -0.780647 -1.306882
H 6.089250 0.675987 -2.191632
H 0.240938 -1.797978 2.918772
H 0.407280 -3.445872 2.198847
H -0.520734 -2.166102 1.320451
H -5.381326 -1.319378 0.975255
H -3.718463 -3.154237 -0.907706
H -1.907417 -3.102986 -0.879692
H -2.772607 -3.483978 -2.417521


