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9
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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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12 0 1 3 0.05 0.35
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13 0 1 4 0.05 0.35
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14 0 2 0 0.00 0.00
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15 0 2 1 0.00 0.15
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16 0 2 2 0.00 0.15
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17 0 2 3 0.00 0.15
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18 0 2 4 0.00 0.15
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19 1 1 1 0.30 0.30
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20 1 1 2 0.30 0.50
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21 1 1 3 0.30 0.50
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22 1 1 4 0.30 0.50
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23 2 1 2 0.50 0.50
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24 2 1 3 0.50 0.50
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25 2 1 4 0.50 0.50
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26 3 1 3 0.50 0.50
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27 3 1 4 0.50 0.50
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28 4 1 4 0.50 0.50
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29 1 2 1 0.30 0.30
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30 1 2 2 0.25 0.25
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31 1 2 3 0.25 0.25
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32 1 2 4 0.25 0.25
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33 2 2 2 0.25 0.25
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34 2 2 3 0.25 0.25
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35 2 2 4 0.25 0.25
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36 3 2 3 0.25 0.25
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37 3 2 4 0.25 0.25
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38 4 2 4 0.25 0.25
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39 $
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