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Non-transparent code: multiplying by 2 #60

@robbieandrew

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@robbieandrew

### Why are we just multiplying by 2?

I presume the reason is that the data represent mass of sulphur and this multiplication converts to mass of SO2.
S = 32, O = 16, so one mole of SO2 is twice the mass of one mole of S.
This should be made more transparent in the code rather than just multiplying by 2.

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