{#
software = "xtb"
jobtype = "constraint"
requires = []
description = "XTB constraint file — edit atoms and values as needed, pass with --input flag"
#}
$constrain
  force constant=0.5
  distance: 12, 32, auto
  distance: 32, 35, auto
  angle: 12, 32, 35, 180
$end
