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note
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Conventional reliability indices: R = X∥F∥ - ∥FC∥/I∥F0∥, and A = (I(∥F0∥ - lFc∥)2/lwjF0∥2)1/2, where F0 and Fc are observed and calculated structure factors, w = 1/oiF)2, and where a(F) is the estimated standard deviation in F0.
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