ATOM 36
1 C1z C 28.6976 -19.1194
2 C1y C 28.6976 -20.4289
3 C1y C 30.9653 -19.1194
4 O7x O 28.6915 -17.8278
5 C2x C 27.5608 -18.4766
6 C1y C 29.8285 -21.0896
7 C1z C 27.5608 -21.0896
8 C1z C 30.9653 -20.4289
9 C1x C 32.0963 -18.4528
10 C7x C 27.1203 -19.7384
11 C2x C 26.4417 -19.1194
12 C6a C 29.8285 -22.8276
13 C1y C 26.4417 -20.4289
14 C1a C 27.5608 -22.3871
15 C1x C 32.1082 -21.0896
16 C1x C 30.9593 -22.1192
17 C1x C 33.2451 -19.1134
18 O6a O 28.2036 -19.6968
19 O6a O 28.7095 -23.4763
20 O6a O 30.9534 -23.4763
21 O2a O 25.3108 -21.0717
22 C1z C 33.2510 -20.4347
23 C2y C 33.2451 -22.1192
24 C1y C 24.1917 -21.7205
25 O1a O 34.5426 -20.4289
26 C2a C 34.1617 -23.0358
27 O2x O 23.0610 -21.0717
28 C1y C 24.1917 -23.0180
29 C1y C 21.9361 -21.7205
30 C1y C 23.0610 -23.6608
31 O1a O 25.3108 -23.6608
32 C1y C 21.9361 -23.0180
33 C1b C 20.8289 -21.0717
34 O1a O 23.0610 -24.9525
35 O1a O 20.8289 -23.6608
36 O1a O 19.8409 -21.9109
BOND 41
1 1 2 1
2 1 3 1
3 1 4 1 #Down
4 1 5 1
5 2 6 1
6 2 7 1
7 3 8 1
8 3 9 1
9 4 10 1
10 5 11 2
11 6 12 1 #Up
12 7 13 1
13 7 14 1 #Up
14 8 15 1
15 8 16 1 #Up
16 9 17 1
17 10 18 2
18 12 19 1
19 12 20 2
20 13 21 1 #Up
21 15 22 1
22 16 23 1
23 24 21 1 #Up
24 22 25 1 #Down
25 23 26 2
26 24 27 1
27 24 28 1
28 27 29 1
29 28 30 1
30 28 31 1 #Down
31 29 32 1
32 29 33 1 #Up
33 30 34 1 #Up
34 32 35 1 #Down
35 33 36 1
36 6 8 1
37 7 10 1 #Down
38 11 13 1
39 17 22 1
40 22 23 1 #Up
41 30 32 1
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