%chk=000100937.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100937

0 1
 O    2.854600     -0.2491000      0.2159000    
 O   -2.931700      0.5691000      6.2399998E-02
 O    4.429700       1.313900     -0.4268000    
 O   -4.578500      -1.023700      0.3590000    
 C   0.5522000     -0.3097000     -0.4162000    
 C    1.860900      0.4212000     -0.5490000    
 C  -0.5885000      0.2241000      6.1700001E-02
 C   -1.927000     -0.4289000      0.1992000    
 C   0.5737000      -1.739400     -0.8946000    
 C    4.103100      0.3079000      0.1884000    
 C   -4.222600      0.1306000      0.1642000    
 C    5.040300     -0.4996000       1.034500    
 C   -5.166000       1.283600      1.5000000E-03
 H    2.158500      0.4436000      -1.604400    
 H    1.764500       1.453800     -0.1925000    
 H  -0.5406000       1.254900      0.4120000    
 H   -2.092500      -1.187400     -0.5713000    
 H   -2.005400     -0.8806000       1.194400    
 H  -0.3219000      -2.312700     -0.6458000    
 H   0.7010000      -1.766200      -1.982000    
 H    1.411300      -2.281000     -0.4417000    
 H    5.106500      -1.518400      0.6446000    
 H    4.692200     -0.5052000       2.070400    
 H    6.036500     -4.9300000E-02   1.003600    
 H   -5.032100       1.735500     -0.9846000    
 H   -4.990500       2.019900      0.7898000    
 H   -6.195800      0.9242000      8.3099999E-02


%chk=000100937-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000100937

0 1
O 2.725292 -0.006716 0.840401
O -3.039589 -0.288578 -0.489141
O 3.862721 0.654418 -1.095614
O -3.788167 0.625723 1.522978
C 0.416811 -0.243351 -0.034671
C 1.495162 0.731533 0.393907
C -0.794548 -0.203918 0.593709
C -1.989690 -1.060340 0.279023
C 0.799463 -1.171264 -1.169813
C 3.849497 0.055667 0.003675
C -3.885568 0.519009 0.278592
C 5.013684 -0.672114 0.640111
C -4.917224 1.191951 -0.601979
H 1.790954 1.394485 -0.441788
H 1.188660 1.325505 1.269284
H -0.948576 0.514050 1.410591
H -1.762884 -1.902962 -0.389489
H -2.461536 -1.422688 1.209929
H -0.061579 -1.713825 -1.589980
H 1.281222 -0.600471 -1.985442
H 1.540856 -1.917858 -0.826142
H 4.668172 -1.565084 1.184158
H 5.507120 -0.004548 1.369973
H 5.747070 -0.946995 -0.132402
H -5.722409 0.473692 -0.841478
H -4.466252 1.517432 -1.552827
H -5.356762 2.048348 -0.069764


