%chk=sp_ts_propanediol_formation.chk
%mem=20GB
%nprocshared=12
#p ub3lyp
scrf=(smd,solvent=dichloroethane) pop=full def2tzvpp
empiricaldispersion=gd3bj gfinput iop(6/7=3) scf=(save,xqc)

Title Card Required

1 2
 C                  1.34912700    0.25554200    0.06000000
 C                 -0.00007700   -0.37523500   -0.40622400
 C                 -1.34070200    0.28196700    0.02469500
 F                  2.32492400   -0.59320900   -0.24982400
 F                  1.34834800    0.49171900    1.35565000
 F                  1.50925700    1.38737900   -0.60862600
 F                 -2.34229000   -0.50281300   -0.34221000
 F                 -1.35361800    0.43504900    1.34363600
 F                 -1.44010100    1.45643200   -0.57296100
 O                 -0.05544000   -0.94715600   -1.54311800
 H                  0.81905400   -1.21617300   -1.92467900
 O                 -0.00762500   -1.73667400    0.89277800
 H                 -0.78329000   -2.35784000    0.72558600


