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18
19
20
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22
23
24
25
26
27
28
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31
32
33
34
35
36
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39
40
41
42
43
44
45
46
47
48
49
50
51
52
53
54
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56
57
58
59
60
61
62
63
64
65
66
67
68
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70
71
72
73
74
75
76
77
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79
80
81
82
83
84
85
86
87
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89
90
91
92
93
94
95
96
97
98
99
100
101
102
103
104
105
106
107
108
109
110
111
112
113
114
115
116
117
118
119
120
121
122
123
124
125
126
127
128
129
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138
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Position data for Silicon-Carbon system
128 atoms
2 atom types
-6.00 5.97232152 xlo xhi
-6.00 5.97232152 ylo yhi
-6.00 5.97232152 zlo zhi
Atoms
1 2 -2.9378454 -4.4592615 -4.8109196
2 2 5.6222143 -2.7335026 -1.7157569
3 2 -2.6614623 -5.5431059 1.6353686
4 2 -5.4326838 -4.6174577 5.9452279
5 2 5.8679239 -0.1120535 -3.5839373
6 2 -3.7174621 -0.6623311 -0.3714789
7 2 -5.0724728 -2.5671623 4.4103461
8 2 -3.3951436 0.9341126 4.9310702
9 2 -5.4347593 1.9523767 -5.6180938
10 2 -4.5884719 2.2904528 -1.0597739
11 2 -5.9058662 0.6212406 2.0127574
12 2 -4.7680660 0.1965740 4.3267764
13 2 -5.4228882 5.2569673 -4.5162920
14 2 -5.2683965 -5.9193658 -2.8648668
15 2 -2.8610884 1.0484664 2.0299077
16 2 -4.0711084 5.3133026 3.8009514
17 2 -0.1947147 -4.1677696 -5.6950931
18 2 -2.9892710 -3.1647368 -1.6173910
19 2 -0.9129311 -4.3819066 -0.1601859
20 2 -2.4513693 -5.2466501 4.8882912
21 2 -2.8879952 -0.1633446 -3.3401150
22 1 -4.6738762 -1.3807254 -2.2946777
23 2 -0.6973948 -1.4885343 0.6005156
24 1 -2.7392164 -2.4774843 0.2387186
25 2 -2.6551254 -2.7229952 2.6350264
26 1 -3.4644263 -4.6028144 3.3817786
27 2 0.7227614 -2.0709446 2.9214737
28 1 -2.1000577 -3.2131296 5.7273437
29 2 -3.1057649 2.3204819 -2.2725622
30 1 -2.2298751 0.7168389 -1.3107201
31 2 -1.8698261 1.4006751 0.7265108
32 1 -4.1103409 -0.7093340 1.9341753
33 2 -0.3505581 3.2707182 -0.2880656
34 1 -3.4045407 -1.4383961 4.3903527
35 2 -3.0940529 1.4132478 -5.3635505
36 1 -4.4560663 1.2072875 -3.7310176
37 2 -2.6061002 4.6373499 -4.6903941
38 1 -3.3477444 4.6768137 -2.6284678
39 2 0.8121697 4.8602418 -4.6710946
40 1 -2.5756922 3.3740738 -0.2136350
41 2 -0.3867976 5.8745611 -2.1119905
42 1 -1.6766249 1.3374292 3.8741477
43 2 -0.8770613 3.3735941 4.3846975
44 1 -1.8609254 3.3158245 -5.9786556
45 1 -5.2732321 -4.6073253 -0.9581754
46 1 -2.7888697 -5.6910152 -0.7922023
47 1 -2.4717165 4.5801880 2.5083210
48 1 -3.8819950 5.8456589 -5.7563384
49 2 2.2314782 -2.7729214 -5.2356862
50 2 0.2981976 -3.1385279 -3.1608167
51 2 2.8810785 -3.4658695 -0.5823196
52 2 0.2509625 -5.7595229 2.7389761
53 2 -0.2934120 -0.8029431 -3.3698507
54 1 -1.0075690 -2.0481922 -1.9419298
55 2 2.0729069 1.4922441 -2.3898096
56 1 1.1110944 -3.2004208 0.9491078
57 2 1.6774298 -0.7901860 2.5158773
58 1 -0.8342297 -4.3342518 2.0971458
59 2 3.2747406 -1.3107897 4.7884706
60 1 1.7126246 -3.3691471 4.5581012
61 2 0.4770605 1.7769008 -5.3339915
62 1 0.2944391 0.5892781 -2.2030106
63 2 2.2039275 3.1557557 -2.0276796
64 1 -0.0404494 0.4767818 1.0396418
65 2 1.1395867 2.3763443 2.3481007
66 1 -0.9738374 -1.6325161 3.7538567
67 2 -0.3291998 0.2996990 5.2770809
68 1 -1.6185604 -0.3964274 -5.1771220
69 2 2.5999949 -5.1977715 5.8230717
70 1 -1.6270675 2.3210900 -3.6299941
71 2 3.6532700 4.9282597 -5.4319276
72 1 0.0788934 4.0241037 -2.5011530
73 2 2.8556507 2.6168653 2.1125546
74 1 0.9738989 2.6255364 4.3412121
75 2 3.7452938 3.4521356 4.5946426
76 1 2.0805182 4.7039015 5.3280260
77 1 -1.0324174 -5.8155041 -4.3265820
78 1 0.7622442 -4.3631629 -1.3156572
79 1 0.3263684 3.9937357 1.6172321
80 1 -0.4350105 -5.7997058 4.5959134
81 2 3.9161132 -4.6052788 -3.3191717
82 2 1.9240657 5.7345079 -1.9754251
83 2 -5.9794488 -4.2369359 1.8646522
84 2 4.3339975 -4.4845227 5.3737440
85 2 2.2755456 -0.6327737 -5.7931837
86 1 1.8728190 -1.5504906 -3.4560010
87 2 3.4558100 -1.1054068 -1.8333071
88 1 4.3788172 -1.9466494 -0.3284637
89 2 2.5999235 -3.7548996 2.5740569
90 1 3.9983910 -4.4856603 1.1968663
91 2 -5.7295580 -2.1475672 -5.9963645
92 1 4.2664051 -2.6988975 -5.8005478
93 2 4.5254685 2.2906832 -3.4765798
94 1 2.3603088 1.3416442 -4.4173836
95 2 4.7767057 1.4061217 -0.7524620
96 1 1.8072666 -0.7835973 -0.4581995
97 2 4.4745018 0.3736224 2.1068274
98 1 3.6081170 -1.7315713 2.4019053
99 2 4.6281423 -0.2865409 4.4756524
100 1 1.7975239 0.2893530 4.2330830
101 2 5.8341452 4.4986472 -5.9664541
102 1 3.2401308 4.1655227 -3.5070029
103 2 4.8720339 4.8709982 -2.3364366
104 1 3.5526476 1.2262752 0.6926826
105 2 -5.8173342 4.5420479 1.5578881
106 1 3.9683224 1.5441137 3.8284375
107 2 -5.5349308 1.9067049 3.7504113
108 1 4.4728615 2.6415574 -5.5952809
109 1 1.7000950 -4.8115440 -4.1953920
110 1 1.7221527 4.1878404 -0.3712681
111 1 3.9218156 4.5935583 1.3263407
112 1 3.1310195 -5.8922481 3.6001155
113 1 4.7558719 -2.2877771 -3.4742052
114 1 -5.5050300 -2.7027381 0.8748867
115 1 5.8418594 -4.6064370 3.8714113
116 1 -4.7516868 -3.1691984 -4.4099768
117 1 3.9404971 0.7188702 -2.2898786
118 1 -5.6869740 0.2042380 -0.1916738
119 1 5.8949589 -1.2422560 3.1201292
120 1 5.9675804 -0.0712572 5.8964022
121 1 -5.6208517 3.3600036 -2.9493510
122 1 5.2065263 3.4517912 -0.3800894
123 1 -4.6994522 2.5489583 1.8297431
124 1 -4.0758407 3.0726196 5.0647973
125 1 4.1587591 -5.0896820 -1.1443498
126 1 -4.6963753 -5.7429833 1.1357818
127 1 5.5994192 4.6887008 3.5948264
128 1 5.0988369 -5.3774409 -4.9051267
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