%chk=000065942.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065942

0 1
 S    2.561800     -0.6917000      -1.041600    
 S    7.695100       2.316500      0.7125000    
 F   -5.197300     -0.3649000      0.8628000    
 F   -4.655800     -0.9489000      -1.164800    
 F   -5.929000       1.391100      -1.045000    
 F   -3.884100       1.559500      -1.774100    
 F   -3.083100       2.436500      0.7257000    
 F   -4.636900       3.646600     -0.2111000    
 F   -5.135600       2.306100       1.437700    
 O   -2.801500      -1.695800      0.7113000    
 O    3.003200      -1.859900      -1.864400    
 N    5.157900      0.3392000      -1.385100    
 N    4.161800      0.7264000      0.7118000    
 N   0.9408000      -3.453700      0.2931000    
 C   -4.351200     -8.1000000E-02 -0.1610000    
 C   -4.624500       1.327100     -0.6593000    
 C   -2.924200     -0.3423000      0.2847000    
 C    2.051700      -1.323000      0.5885000    
 C    4.080400      0.2021000     -0.5122000    
 C   0.7969000      -2.126700      0.5077000    
 C    5.988600       1.039100     -0.5668000    
 C   -4.376300       2.438100      0.3311000    
 C   -1.568300      -2.274500      0.5740000    
 C    5.410000       1.264900      0.6543000    
 C  -0.4264000      -1.492900      0.6539000    
 C   -1.468800      -3.639600      0.3550000    
 C    7.225400       1.518400     -0.7614000    
 C    6.188400       1.960800       1.520600    
 C  -0.1988000      -4.177500      0.2220000    
 H   -2.666400      0.2874000       1.140500    
 H   -2.262000     -0.1284000     -0.5634000    
 H    1.914200     -0.4760000       1.269400    
 H    2.866100      -1.939500      0.9858000    
 H    5.301800      2.4900001E-02  -2.336700    
 H  -0.4573000     -0.4266000      0.8489000    
 H   -2.349100      -4.268900      0.2886000    
 H    7.862600       1.458300      -1.632300    
 H    6.000600       2.280700       2.535300    
 H  -6.0899999E-02  -5.239700      4.8999999E-02


%chk=000065942-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000065942

0 1
S 3.346941 -2.365737 -1.054983
S 3.421282 3.924630 0.346528
F -3.974651 0.539474 0.527028
F -3.360473 0.507512 -1.673931
F -3.537363 3.033509 -1.073138
F -1.307911 2.553185 -0.896897
F -1.771292 2.220491 1.998550
F -1.992219 4.266041 1.042849
F -3.836712 3.111043 1.660967
O -2.180266 -1.480154 -0.116549
O 5.000620 -2.519642 -0.780669
N 4.367921 0.091618 -0.321008
N 2.074706 0.231884 -0.578118
N 0.608852 -4.648848 0.248253
C -2.887354 0.785394 -0.365036
C -2.590202 2.331005 -0.308490
C -1.688246 -0.104832 -0.037911
C 2.488878 -3.136807 0.595589
C 3.164276 -0.538988 -0.601582
C 1.022299 -3.349661 0.386079
C 4.052611 1.437864 -0.080082
C -2.561880 2.990148 1.117853
C -1.220874 -2.486390 0.040289
C 2.598117 1.516563 -0.243916
C 0.144479 -2.238347 0.294386
C -1.678354 -3.820657 -0.077310
C 4.673172 2.629084 0.239753
C 2.086606 2.790684 -0.049216
C -0.727029 -4.854255 0.036916
H -1.316297 0.120552 0.978662
H -0.879033 0.081311 -0.769446
H 2.755581 -2.408430 1.374900
H 3.037049 -4.083965 0.705288
H 5.249430 -0.439462 -0.323216
H 0.556495 -1.227176 0.363061
H -2.734351 -4.030267 -0.264204
H 5.715215 2.878907 0.418527
H 1.068790 3.165017 -0.121173
H -1.039012 -5.900099 -0.053606


