ATOM 32
1 C1y C 26.0887 -18.8746
2 N1y N 26.0887 -20.2664
3 C2y C 27.2941 -20.9622
4 C2y C 28.4994 -20.2664
5 C1x C 28.4994 -18.8746
6 S2x S 27.2941 -18.1787
7 C1y C 24.6968 -18.8746
8 C5x C 24.6968 -20.2664
9 N1b N 23.4918 -18.1787
10 C5a C 22.2863 -18.8746
11 O5a O 22.2863 -20.2664
12 O5x O 23.4918 -20.9622
13 C2c C 21.0809 -18.1787
14 C1b C 29.7233 -20.9733
15 C8y C 19.8563 -18.8862
16 N2y N 30.9336 -20.2748 #+
17 C8x C 18.7452 -18.0258
18 S2x S 17.5793 -18.8158
19 C8y C 17.9705 -20.1686
20 N5x N 19.3779 -20.2149
21 N2b N 21.0808 -16.7655
22 C6a C 27.2941 -22.3706
23 O6a O 28.5101 -23.0726 #-
24 O6a O 26.0798 -23.0718
25 C1x C 30.9338 -18.8628
26 C1x C 32.2764 -20.7113
27 C1x C 33.1064 -19.5690
28 C1x C 32.2767 -18.4266
29 C1a C 30.9336 -21.6780
30 N1a N 17.1422 -21.2751
31 O2a O 22.2702 -16.0793
32 C1a C 22.2705 -14.7000
BOND 35
1 1 2 1
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 1
6 1 6 1
7 1 7 1
8 7 8 1
9 2 8 1
10 7 9 1 #Up
11 9 10 1
12 10 11 2
13 8 12 2
14 10 13 1
15 4 14 1
16 13 15 1
17 14 16 1
18 15 17 2
19 17 18 1
20 18 19 1
21 19 20 2
22 15 20 1
23 13 21 2
24 3 22 1
25 22 23 1
26 22 24 2
27 16 25 1
28 16 26 1
29 26 27 1
30 27 28 1
31 25 28 1
32 16 29 1
33 19 30 1
34 21 31 1
35 31 32 1
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