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annotate CADDSuite-1.5/data/OpenBabel/mmffdfsb.par @ 7:bfab27640f5e draft

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CADDSuite version 1.5
author Marcel Schumann <schumann.marcel@gmail.com>
date Tue, 24 Jul 2012 11:13:59 -0400
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1 *
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2 * Copyright (c) Merck and Co., Inc., 1994
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3 * All Rights Reserved
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4 *
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5 * MMFF Default Stretch-Bend Parameters
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6 * Row in
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7 * Periodic Table
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8 * IR JR KR F(I_J,K) F(K_J,I)
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9 0 1 0 0.15 0.15
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10 0 1 1 0.10 0.30
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11 0 1 2 0.05 0.35
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39 $