| Revision: | 156 |
| Committed: | Tue Oct 26 22:24:30 2004 UTC (20 years, 7 months ago) by gezelter |
| File size: | 2905 byte(s) |
| Log Message: | adding sample shape directory |
| # | User | Rev | Content |
|---|---|---|---|
| 1 | gezelter | 156 | begin ShapeInfo |
| 2 | #name mass I_xx I_yy I_zz | ||
| 3 | samples/8CB_RB_0 291.418 9075.89 8882.85 461.926 | ||
| 4 | end ShapeInfo | ||
| 5 | |||
| 6 | begin ContactFunctions | ||
| 7 | #l m sin or cos coeff (Ang) | ||
| 8 | 0 0 cos 23.3499 | ||
| 9 | 1 0 cos 1.30727 | ||
| 10 | 1 1 cos -6.19368 | ||
| 11 | 1 1 sin 1.50121 | ||
| 12 | 2 0 cos 12.1161 | ||
| 13 | 2 1 cos 2.16646 | ||
| 14 | 2 2 cos -1.43598 | ||
| 15 | 2 2 sin 1.1559 | ||
| 16 | 3 0 cos -1.1823 | ||
| 17 | 3 1 cos 3.31381 | ||
| 18 | 3 1 sin -0.769974 | ||
| 19 | 3 2 cos -0.831587 | ||
| 20 | 3 2 sin 1.56264 | ||
| 21 | 3 3 cos 0.274396 | ||
| 22 | 4 0 cos 5.86273 | ||
| 23 | 4 2 cos 1.94628 | ||
| 24 | 4 2 sin 0.480478 | ||
| 25 | 4 3 cos 0.551522 | ||
| 26 | 5 0 cos -1.00395 | ||
| 27 | 5 1 cos 2.9094 | ||
| 28 | 5 1 sin -1.11618 | ||
| 29 | 5 2 cos 0.640099 | ||
| 30 | 5 2 sin 1.102 | ||
| 31 | 5 3 cos 0.250024 | ||
| 32 | 5 3 sin 0.288602 | ||
| 33 | 5 4 sin 0.362453 | ||
| 34 | 6 0 cos 1.76653 | ||
| 35 | 6 1 cos -1.03269 | ||
| 36 | 6 1 sin -0.273019 | ||
| 37 | 6 2 cos 1.17097 | ||
| 38 | 6 2 sin 0.23873 | ||
| 39 | 6 3 sin 0.254174 | ||
| 40 | 7 0 cos -0.355895 | ||
| 41 | 7 1 cos 1.64621 | ||
| 42 | 7 1 sin -0.676949 | ||
| 43 | 7 2 sin 0.284058 | ||
| 44 | 7 3 cos 0.303004 | ||
| 45 | end ContactFunctions | ||
| 46 | |||
| 47 | begin RangeFunctions | ||
| 48 | #l m sin or cos coeff (Ang) | ||
| 49 | 0 0 cos 21.5424 | ||
| 50 | 1 0 cos -1.00881 | ||
| 51 | 1 1 cos 5.5845 | ||
| 52 | 1 1 sin -1.55606 | ||
| 53 | 2 0 cos 5.065 | ||
| 54 | 2 1 cos -0.398058 | ||
| 55 | 2 1 sin -0.363071 | ||
| 56 | 2 2 cos 1.49821 | ||
| 57 | 2 2 sin -0.584146 | ||
| 58 | 3 0 cos -0.804836 | ||
| 59 | 3 1 cos 4.06438 | ||
| 60 | 3 1 sin -1.16511 | ||
| 61 | 3 2 cos 0.9521 | ||
| 62 | 3 2 sin -0.658447 | ||
| 63 | 4 0 cos -1.83456 | ||
| 64 | 4 1 cos -1.11393 | ||
| 65 | 4 1 sin -0.568905 | ||
| 66 | 4 2 cos 1.01963 | ||
| 67 | 4 2 sin -1.26495 | ||
| 68 | 4 3 cos -0.307852 | ||
| 69 | 4 3 sin -0.272891 | ||
| 70 | 4 4 cos -0.234629 | ||
| 71 | 5 0 cos 0.323826 | ||
| 72 | 5 1 cos -0.798556 | ||
| 73 | 5 1 sin 0.34521 | ||
| 74 | 5 2 cos -0.283527 | ||
| 75 | 5 2 sin -1.63918 | ||
| 76 | 5 3 cos 0.652963 | ||
| 77 | 5 3 sin -1.07306 | ||
| 78 | 5 4 cos -0.361564 | ||
| 79 | 5 4 sin -0.4022 | ||
| 80 | 6 0 cos -2.67797 | ||
| 81 | 6 1 cos 0.457307 | ||
| 82 | 6 1 sin 0.311701 | ||
| 83 | 6 2 cos -0.928681 | ||
| 84 | 6 2 sin -0.394072 | ||
| 85 | 6 3 cos -0.698392 | ||
| 86 | 6 3 sin -0.597206 | ||
| 87 | 6 4 sin -0.867001 | ||
| 88 | 6 5 sin -0.237245 | ||
| 89 | 7 0 cos 0.555503 | ||
| 90 | 7 1 cos -2.01645 | ||
| 91 | 7 1 sin 1.56018 | ||
| 92 | 7 2 cos -0.232323 | ||
| 93 | 7 2 sin -1.3107 | ||
| 94 | 7 3 sin -0.331124 | ||
| 95 | 7 4 sin -0.914931 | ||
| 96 | 7 5 cos -0.533153 | ||
| 97 | 7 5 sin -0.669356 | ||
| 98 | 7 6 cos -0.304081 | ||
| 99 | 7 6 sin -0.313811 | ||
| 100 | 7 7 sin -0.371763 | ||
| 101 | end RangeFunctions | ||
| 102 | |||
| 103 | begin StrengthFunctions | ||
| 104 | #l m sin or cos coeff (kcal/mol) | ||
| 105 | 0 0 cos 10.8469 | ||
| 106 | 1 0 cos 0.686965 | ||
| 107 | 1 1 cos 3.52675 | ||
| 108 | 1 1 sin -0.755068 | ||
| 109 | 2 0 cos -1.90532 | ||
| 110 | 2 1 cos -1.22806 | ||
| 111 | 2 1 sin 0.137434 | ||
| 112 | 2 2 cos 3.58952 | ||
| 113 | 2 2 sin -1.95111 | ||
| 114 | 3 0 cos 0.174899 | ||
| 115 | 3 1 cos -2.88545 | ||
| 116 | 3 1 sin 0.704704 | ||
| 117 | 3 2 cos 1.36574 | ||
| 118 | 3 2 sin -1.85845 | ||
| 119 | 3 3 cos 0.57095 | ||
| 120 | 3 3 sin -0.55015 | ||
| 121 | 4 0 cos -1.24701 | ||
| 122 | 4 1 cos 0.65789 | ||
| 123 | 4 1 sin 0.217853 | ||
| 124 | 4 2 cos -3.0503 | ||
| 125 | 4 2 sin -0.213451 | ||
| 126 | 4 3 cos -0.993437 | ||
| 127 | 4 3 sin 0.293149 | ||
| 128 | 4 4 cos 0.679162 | ||
| 129 | 4 4 sin -0.822218 | ||
| 130 | 5 0 cos -0.423881 | ||
| 131 | 5 1 cos 0.223276 | ||
| 132 | 5 1 sin 0.571002 | ||
| 133 | 5 2 cos -0.987755 | ||
| 134 | 5 2 sin -1.12455 | ||
| 135 | 5 3 cos -0.864378 | ||
| 136 | 5 3 sin 0.164922 | ||
| 137 | 5 4 cos 0.412011 | ||
| 138 | 5 4 sin -0.731791 | ||
| 139 | 6 1 cos -0.112802 | ||
| 140 | 6 1 sin 0.640058 | ||
| 141 | 6 2 cos -0.462719 | ||
| 142 | 6 2 sin -0.65862 | ||
| 143 | 6 3 sin -0.151269 | ||
| 144 | 6 4 cos -0.43337 | ||
| 145 | 6 4 sin 0.26716 | ||
| 146 | 6 5 cos -0.173329 | ||
| 147 | 6 5 sin 0.32612 | ||
| 148 | 6 6 sin -0.258538 | ||
| 149 | 7 1 sin 0.140449 | ||
| 150 | 7 2 cos -0.555775 | ||
| 151 | 7 2 sin 0.176097 | ||
| 152 | 7 3 cos 0.231765 | ||
| 153 | 7 3 sin 0.123532 | ||
| 154 | 7 4 cos -0.491483 | ||
| 155 | 7 4 sin 0.560248 | ||
| 156 | 7 5 cos -0.153549 | ||
| 157 | 7 5 sin 0.381444 | ||
| 158 | 7 6 sin -0.238173 | ||
| 159 | end StrengthFunctions |