%mem=20GB
%nprocshared=12
# scrf=(smd,solvent=generic,read) def2tzvp empiricaldispersion=gd3 m062x

intV-tBu

0 1
 C                  2.76697500    0.25556100   -0.11369600
 C                  3.79023600    0.00190100   -1.05852600
 C                  2.97801100   -0.25122200    1.18693300
 C                  4.93239400   -0.72005300   -0.73312800
 H                  3.67199200    0.38997600   -2.07500000
 C                  4.12359300   -0.98200000    1.51192700
 H                  2.23113400   -0.07371600    1.96298500
 C                  5.11159700   -1.22597000    0.55982500
 H                  5.69764000   -0.88766700   -1.49494400
 H                  4.24468800   -1.35828500    2.53075600
 H                  6.00770900   -1.79292500    0.81733100
 C                 -2.22915400   -0.39756500   -0.53345900
 O                 -1.66030900   -1.35382200   -1.19066000
 C                 -1.72934100    1.94838300    0.20646300
 C                 -0.35379000    2.62837700    0.23082100
 C                  0.80522900    1.70227600    0.65756000
 C                  1.54911400    1.00255700   -0.49865000
 H                 -2.48188100    2.65898300   -0.17909300
 H                 -0.14235100    3.04122700   -0.77129300
 H                 -0.41506100    3.48993200    0.91359500
 H                  1.52808000    2.29376300    1.25324100
 H                  0.39611900    0.95798300    1.36723900
 H                  1.81808600    1.75620500   -1.26031800
 H                 -2.02414400    1.70373300    1.24190100
 N                 -1.63916400    0.76781200   -0.61922100
 Mg                -0.00364400   -0.17597700   -1.42780500
 C                 -3.46667900   -0.74154600    0.29980200
 C                 -2.99430100   -1.02125100    1.73670900
 H                 -2.52495100   -0.13768600    2.19349200
 H                 -3.85439300   -1.31025900    2.36047700
 H                 -2.26667200   -1.84669500    1.75152800
 C                 -4.48652500    0.40266000    0.27997400
 H                 -5.40962200    0.07683500    0.78321000
 H                 -4.12540400    1.29822700    0.80089100
 H                 -4.74469800    0.68408500   -0.75258800
 C                 -4.12025500   -2.00450200   -0.26890700
 H                 -4.99933900   -2.26884300    0.33822500
 H                 -4.45140700   -1.84571400   -1.30608800
 H                 -3.41778900   -2.84717100   -0.26394900

solventname=dimethoxyethane
eps=7.2
epsinf=1.904


