%mem=3000MB
%nprocshared=4
#p opt=(calcfc,ts,noeigentest,maxstep=4) freq=noraman b3lyp/genecp
scrf=(smd,solvent=dichloromethane) nosymm empiricaldispersion=gd3

ch3i-OTf-ts_6311+Gd_ch2lcl2

-1 1
 S                  1.13002400    0.96035600   -1.02599100
 O                  1.79596500    2.11196000   -0.37862100
 O                  1.27465400    0.86210800   -2.49293400
 O                  1.54197700   -0.36143800   -0.36943000
 C                  1.48545500   -0.42905100    1.65855800
 H                  1.95174700    0.53664500    1.74457900
 H                  0.41390800   -0.51774100    1.64564900
 H                  2.09499200   -1.31362600    1.60277300
 I                  1.42679900   -0.61722300    4.36032400
 C                 -0.60827997    1.11563910   -0.67586749
 F                 -1.26873961    0.06105372   -1.19945389
 F                 -1.07732561    2.25714142   -1.22310477
 F                 -0.79715074    1.14649296    0.66049918

-H -C -N -O -P -B -S -Al -Cl -F -He -Si -As -Se 0
6-311+g*
****
I     0
S   2   1.00
      0.7242000             -2.9731048
      0.4653000              3.4827643
S   1   1.00
      0.1336000              1.0000000
P   2   1.00
      1.2900000             -0.2092377
      0.3180000              1.1035347
P   1   1.00
      0.1053000              1.0000000
P   1   1.00
      0.0308                 1.0
D   1   1.00
      0.2940                 1.0
****

I     0
I-ECP     3     46
f potential
  5
0      1.0715702             -0.0747621
1     44.1936028            -30.0811224
2     12.9367609            -75.3722721
2      3.1956412            -22.0563758
2      0.8589806             -1.6979585
s-f potential
  5
0    127.9202670              2.9380036
1     78.6211465             41.2471267
2     36.5146237            287.8680095
2      9.9065681            114.3758506
2      1.9420086             37.6547714
p-f potential
  5
0     13.0035304              2.2222630
1     76.0331404             39.4090831
2     24.1961684            177.4075002
2      6.4053433             77.9889462
2      1.5851786             25.7547641
d-f potential
  5
0     40.4278108              7.0524360
1     28.9084375             33.3041635
2     15.6268936            186.9453875
2      4.1442856             71.9688361
2      0.9377235              9.3630657

