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root/group/trunk/OOPSE-3.0/samples/shape/8CB.shape
Revision: 1649
Committed: Tue Oct 26 22:24:30 2004 UTC (19 years, 8 months ago) by gezelter
File size: 2905 byte(s)
Log Message:
adding sample shape directory

File Contents

# Content
1 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