%chk=000012187.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000012187

0 1
 O  -0.9468000     -0.8888000       1.006700    
 C    1.741500     -0.1171000      0.2061000    
 C   0.5198000      0.8089000      0.1099000    
 C    1.714900      -1.191800     -0.8837000    
 C    3.029400      0.7008000      9.2399999E-02
 C  -0.8131000      9.0499997E-02  0.2748000    
 C   -1.978700      0.6896000     -0.4952000    
 C   -3.266900     -9.2100002E-02 -0.3111000    
 H    1.736500     -0.6191000       1.181700    
 H   0.5644000       1.586000      0.8818000    
 H   0.5226000       1.312100     -0.8647000    
 H    2.606700      -1.825000     -0.8231000    
 H    1.688300     -0.7431000      -1.882700    
 H   0.8438000      -1.846500     -0.7839000    
 H    3.091600       1.215600     -0.8725000    
 H    3.909500      5.6299999E-02  0.1899000    
 H    3.080200       1.456300      0.8837000    
 H   -2.120300       1.719800     -0.1520000    
 H   -1.714700      0.7056000      -1.557900    
 H   -3.565700     -0.1155000      0.7422000    
 H   -4.077000      0.3671000     -0.8859000    
 H   -3.150600      -1.127000     -0.6496000    


%chk=000012187-Freq.chk
%nprocshared=24
%mem=100GB
#p freq=noraman PBEPBE/SDD

000012187

0 1
O -0.922153 -1.067494 0.805359
C 1.761992 -0.149206 0.150152
C 0.502403 0.726964 -0.054005
C 1.907819 -1.184250 -0.990137
C 3.024386 0.735473 0.265002
C -0.830422 -0.010950 0.124646
C -2.048862 0.619244 -0.557271
C -3.396575 0.032469 -0.103937
H 1.623604 -0.705572 1.097976
H 0.499842 1.555492 0.688934
H 0.520963 1.218736 -1.048527
H 2.794682 -1.823908 -0.827568
H 2.031503 -0.678790 -1.968268
H 1.023749 -1.843809 -1.045130
H 3.181043 1.325880 -0.659041
H 3.926349 0.115639 0.422611
H 2.948126 1.444116 1.111528
H -2.010384 1.717114 -0.402505
H -1.911383 0.477637 -1.651474
H -3.563143 0.212765 0.972453
H -4.231806 0.484868 -0.667617
H -3.416332 -1.059818 -0.256283


