$coord
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    0.37213827859462     -1.76613592564415      1.32127144641022  c
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   -8.92802164557435     -0.98904475263639     -0.95701363011618  h
  -10.23390262134738      1.97023880803625      0.07672644023070  h
   -9.02430478154600     -0.23996902336853      2.35303783320605  h
$user-defined bonds
$end
