ATOM 32
1 C1y C 29.9818 -16.8704
2 C1y C 31.1929 -17.5745
3 C1y C 32.4057 -16.8732
4 C1y C 32.4072 -15.4749
5 C1y C 31.1963 -14.7779
6 C1y C 29.9835 -15.4720
7 C1y C 25.1378 -18.2785
8 C1y C 25.1378 -19.6797
9 C1y C 26.3550 -20.3838
10 C1y C 27.5652 -19.6797
11 C1y C 27.5652 -18.2785
12 O2x O 26.3550 -17.5814
13 O2a O 28.7731 -17.5824
14 N1b N 28.7731 -20.3828
15 O1a O 23.9237 -20.3843
16 C1b C 23.9237 -17.5809
17 O1a O 26.3568 -21.7848
18 O1a O 22.7016 -18.2645
19 O1a O 31.1980 -13.3769
20 O1a O 33.6191 -17.5787
21 O1a O 31.1912 -18.9755
22 O1a O 28.7701 -14.7737
23 O1a O 33.6225 -14.7794
24 C5a C 28.7638 -21.7779
25 C1c C 29.9749 -22.4749
26 N1b N 31.1900 -21.7792
27 C1b C 29.9732 -23.8760
28 C5a C 32.4035 -22.4778
29 C1a C 33.6188 -21.7821
30 O5a O 32.4019 -23.8788
31 O5a O 27.5537 -22.4702
32 S1a S 28.7579 -24.5786
BOND 33
1 7 16 1 #Up
2 3 4 1
3 9 17 1 #Up
4 4 5 1
5 16 18 1
6 1 13 1 #Up
7 5 6 1
8 5 19 1 #Up
9 7 8 1
10 3 20 1 #Up
11 8 9 1
12 2 21 1 #Up
13 9 10 1
14 6 22 1 #Down
15 10 11 1
16 4 23 1 #Down
17 11 12 1
18 14 24 1
19 12 7 1
20 24 25 1
21 6 1 1
22 25 26 1
23 11 13 1 #Down
24 25 27 1 #Up
25 26 28 1
26 10 14 1 #Down
27 28 29 1
28 1 2 1
29 28 30 2
30 8 15 1 #Down
31 24 31 2
32 2 3 1
33 27 32 1
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