ATOM 38
1 C1z C 28.4536 -17.2004
2 C1z C 27.2848 -17.8684
3 C1y C 28.3895 -15.8447
4 O2x O 27.5400 -16.1174
5 C1x C 27.0514 -17.2465
6 C1z C 26.1215 -17.1947
7 C1y C 29.7966 -17.8707
8 C1a C 27.2731 -19.2114
9 C1x C 29.8096 -15.8447
10 O2x O 27.2963 -15.1708
11 C1y C 26.1274 -15.8388
12 C1x C 24.9526 -17.8626
13 C1x C 26.5557 -18.4188
14 C2x C 24.9526 -15.1651
15 C1x C 23.7836 -17.1947
16 C2y C 23.7836 -15.8388
17 C1a C 22.6145 -15.1651
18 O7x O 31.0280 -18.4953
19 C7x C 32.2052 -17.8049
20 C2x C 33.3870 -18.4894
21 O6a O 32.2052 -16.4429
22 C2x C 33.3870 -19.8512
23 C2x C 32.2052 -20.5358
24 C2x C 32.2052 -21.8978
25 C1y C 31.0234 -22.5752
26 O2x O 29.8487 -21.8978
27 C1x C 28.6669 -22.5752
28 C1x C 27.4852 -21.8978
29 C1y C 26.3034 -22.5752
30 C1y C 25.1216 -21.8978
31 C1c C 31.0234 -23.9370
32 C1a C 32.2052 -24.6216
33 O1a O 29.8487 -24.6216
34 O1a O 23.9467 -22.5752
35 C7x C 25.1216 -20.5358
36 O6a O 23.9467 -19.8512
37 O7x O 26.3037 -19.8501
38 C1a C 26.3034 -23.9370
BOND 42
1 7 18 1 #Up
2 1 2 1
3 18 19 1
4 1 3 1
5 19 20 1
6 1 4 1 #Down
7 19 21 2
8 1 5 1
9 20 22 2
10 2 6 1
11 22 23 1
12 2 7 1
13 23 24 2
14 2 8 1 #Up
15 24 25 1
16 3 9 1
17 25 26 1
18 3 10 1
19 26 27 1
20 6 11 1
21 27 28 1
22 6 12 1
23 28 29 1
24 6 13 1 #Down
25 29 30 1
26 11 14 1
27 25 31 1
28 12 15 1
29 31 32 1
30 14 16 2
31 31 33 1 #Up
32 16 17 1
33 4 5 1
34 30 34 1 #Down
35 7 9 1
36 30 35 1
37 35 37 1
38 10 11 1
39 35 36 2
40 15 16 1
41 13 37 1
42 29 38 1 #Up
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