ATOM 38
1 C8y C 25.3999 -19.2126
2 C8x C 25.3999 -20.6090
3 C8x C 26.5868 -21.3073
4 C8y C 27.7738 -20.6090
5 C8y C 27.7738 -19.2126
6 C8x C 26.5868 -18.5144
7 N5x N 29.0306 -21.3073
8 C8y C 30.2176 -20.6090
9 C8y C 30.2176 -19.2126
10 C8y C 29.0306 -18.5144
11 O7a O 24.1430 -18.5144
12 C7a C 22.9561 -19.2126
13 O6a O 22.9561 -20.6090
14 N1y N 21.7691 -18.5144
15 C1x C 21.7691 -17.1179
16 C1x C 20.5123 -16.4197
17 C1y C 19.3253 -17.1179
18 C1x C 19.3253 -18.5144
19 C1x C 20.5123 -19.2126
20 N1a N 18.1383 -16.4197
21 C8y C 31.5443 -21.0280
22 N4y N 32.3821 -19.9108
23 C1x C 31.5443 -18.7937
24 C8y C 33.7088 -19.9108
25 C8y C 34.4070 -21.0978
26 C8y C 33.7786 -22.2848
27 C8x C 32.3123 -22.2848
28 C1z C 34.4768 -23.4718
29 C7x C 35.8733 -23.4718
30 O7x O 36.5017 -22.2848
31 C1x C 35.8034 -21.0978
32 O5x O 34.4070 -18.6540
33 O6a O 36.5715 -24.7286
34 C1b C 29.0306 -17.1179
35 C1a C 27.7738 -16.4197
36 C1b C 33.0803 -23.4718
37 O1a O 34.4768 -24.9380
38 C1a C 32.3821 -24.7286
BOND 43
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 4 7 1
8 7 8 2
9 8 9 1
10 9 10 2
11 5 10 1
12 1 11 1
13 11 12 1
14 12 13 2
15 12 14 1
16 14 15 1
17 15 16 1
18 16 17 1
19 17 18 1
20 18 19 1
21 14 19 1
22 17 20 1
23 8 21 1
24 21 22 1
25 22 23 1
26 9 23 1
27 22 24 1
28 24 25 1
29 25 26 2
30 26 27 1
31 26 28 1
32 28 29 1
33 29 30 1
34 30 31 1
35 25 31 1
36 27 21 2
37 24 32 2
38 29 33 2
39 10 34 1
40 34 35 1
41 28 36 1 #Down
42 28 37 1 #Up
43 36 38 1
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