ATOM 38
1 C1y C 18.7311 -12.1612
2 C8y C 17.5429 -11.4623
3 N1x N 19.9192 -11.4623
4 C8y C 17.5429 -10.0644
5 C8x C 16.3547 -12.1612
6 C1x C 19.9192 -10.0644
7 C1x C 18.7311 -9.3655
8 C8x C 16.3547 -9.3655
9 C8y C 15.0967 -11.4623
10 C8y C 15.0967 -10.0644
11 O1a O 13.9085 -12.1612
12 O2a O 13.9085 -9.3655
13 C1y C 19.9192 -16.5644
14 C1y C 19.9192 -15.2365
15 C1y C 21.0375 -17.2633
16 C2b C 18.7311 -17.1934
17 C2y C 21.0375 -14.5375
18 C1b C 18.7311 -14.5375
19 O2a O 22.0160 -18.8009
20 O2x O 22.2257 -16.5644
21 C2a C 17.5429 -16.5644
22 C2x C 22.2257 -15.2365
23 C7a C 21.0375 -13.2096
24 C1y C 20.3386 -19.6397
25 O7a O 22.2257 -12.5107
26 O6a O 19.8493 -12.5107
27 O2x O 19.1504 -18.9407
28 C1y C 20.3386 -20.9676
29 C1a C 23.3439 -13.2096
30 C1y C 17.9622 -19.6397
31 C1y C 19.1504 -21.6665
32 O1a O 21.4568 -21.6665
33 C1y C 17.9622 -20.9676
34 C1b C 16.8440 -18.9407
35 O1a O 19.1504 -22.9945
36 O1a O 16.8440 -21.6665
37 O1a O 15.7956 -19.8493
38 C1a C 12.6961 -10.0655
BOND 41
1 1 2 1
2 1 3 1
3 2 4 2
4 2 5 1
5 3 6 1
6 4 7 1
7 4 8 1
8 5 9 2
9 8 10 2
10 9 11 1
11 10 12 1
12 6 7 1
13 9 10 1
14 13 14 1
15 13 15 1
16 13 16 1
17 14 17 1
18 14 18 1
19 15 19 1 #Up
20 15 20 1
21 16 21 2
22 17 22 2
23 17 23 1
24 24 19 1 #Up
25 23 25 1
26 23 26 2
27 24 27 1
28 24 28 1
29 25 29 1
30 27 30 1
31 28 31 1
32 28 32 1 #Down
33 30 33 1
34 30 34 1 #Up
35 31 35 1 #Up
36 33 36 1 #Down
37 34 37 1
38 20 22 1
39 31 33 1
40 18 1 1
41 12 38 1
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