Commit f8470192 authored by dundaryilmaz's avatar dundaryilmaz

new

parent cde68ad2
monomer 17
vector1 0.000 0.000 0.000
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mer_width 8.8
merlength 8.52
CONNECTIONS
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10 1 1
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13 1 5
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H 1 1
T 1 2
monomer 19
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mer_width 8.8
merlength 8.52
CONNECTIONS
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2 3 1 3 4
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4 3 2 5 9
5 3 4 6 15
6 3 5 7 16
7 3 6 8 17
8 3 7 9 18
9 3 4 8 19
10 1 1
11 1 1
12 1 1
13 1 3
14 1 3
15 1 5
16 1 6
17 1 7
18 1 8
19 1 9
H 1 1
T 1 2
monomer 21
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vector2 2.500 0.000 0.000
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mer_width 2.8
merlength 6.52
monomer 21
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vector2 2.500 0.000 0.000
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HEADH 1 0 -0.8994 0.6512 0.0067 2
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mer_width 2.8
merlength 6.52
monomer 42
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vector2 2.500 0.000 0.000
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mer_width 8.8
merlength 8.52
21
1.0
20.0000 0.0000 0.0000
0.0000 20.0000 0.0000
0.0000 0.0000 20.0000
Direct
1 0.2937 0.2641 0.0968 1 C 12
1 0.5117 0.1733 0.9861 1 C 12
3 0.4730 0.2658 0.9226 1 O 16
1 0.4837 0.2449 0.9885 1 C 12
1 0.5367 0.2905 0.0207 1 C 12
1 0.4175 0.2502 0.0269 1 C 12
1 0.3854 0.3099 0.0299 1 C 12
1 0.3212 0.3170 0.0662 1 C 12
1 0.3275 0.1984 0.0941 1 C 12
1 0.3857 0.1915 0.0613 1 C 12
2 0.5206 0.3436 0.0207 1 H 1
2 0.5464 0.2751 0.0732 1 H 1
2 0.5845 0.2878 0.9924 1 H 1
2 0.5588 0.1719 0.9567 1 H 1
2 0.5228 0.1545 0.0372 1 H 1
2 0.4755 0.1391 0.9615 1 H 1
2 0.4059 0.3539 0.0055 1 H 1
2 0.2964 0.3653 0.0680 1 H 1
2 0.2467 0.2693 0.1234 1 H 1
2 0.3050 0.1556 0.1189 1 H 1
2 0.4087 0.1425 0.0606 1 H 1
monomer 6 atoms polyethylene
vector1 0.000 0.000 0.000
vector2 2.500 0.000 0.000
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H -0.0265 -0.6336 -0.9121 2
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H 1.2472 1.5028 0.9193 2
H 1.2472 1.5216 -0.8879 2
HEADH 1 -0.8994 0.6512 0.0067
TAILH 2 2.1749 0.2380 0.0025
mer_width 3.0
C -0.12 0.0000 0.0000 0.0000 1
C -0.12 1.2574 0.8644 0.0090 1
H 0.06 -0.0265 -0.6336 -0.9121 2
H 0.06 -0.0266 -0.6524 0.8988 2
H 0.06 1.2472 1.5028 0.9193 2
H 0.06 1.2472 1.5216 -0.8879 2
HEADH 1 0.0 -0.8994 0.6512 0.0067 2
TAILH 2 0.0 2.1749 0.2380 0.0025 2
mer_width 2.6
merlength 2.52
0
1.0
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Direct
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