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Update README.md
Co-authored-by: Sebastian Ehlert <28669218+awvwgk@users.noreply.github.com>
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README.md

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@@ -13,7 +13,7 @@ dftd3 package provides a drop-in replacement of pyscf.dftd3.itrf. For example
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```
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from pyscf import gto
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import dftd3.pyscf as itrf
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import dftd3.pyscf as d3
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mol = gto.M(
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atom = ''' O 0.00000000 0.00000000 -0.11081188

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