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@ -74,10 +74,10 @@ of the data file like these with :math:`M` and :math:`N` lines each:
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PiTorsions
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1 1 8 10 12 18 20
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2 5 18 20 22 25 27
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1 1 2 4 3 20 21 24
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2 5 21 23 22 37 38 41
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[...]
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N 3 314 315 317 318 330
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N 7 27 29 28 30 35 36
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For PiTorsion Coeffs, the first column is an index from 1 to :math:`M`
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to enumerate the pitorsion types. The second column is the single
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