ATOM 31
1 C8x C 34.2930 -23.3735
2 C8y C 34.2930 -24.7735
3 C8x C 35.5084 -25.4736
4 C8x C 36.7167 -24.7735
5 N5y N 36.7167 -23.3735 #+
6 C8x C 35.5084 -22.6735
7 N1y N 26.0832 -25.3760
8 C1y C 26.0832 -23.9715
9 C2y C 27.4174 -25.7972
10 C5x C 24.6787 -25.3818
11 C1y C 24.6787 -23.9715
12 C1y C 27.4114 -23.5444
13 C2y C 28.2365 -24.6678
14 C6a C 27.8562 -27.1314
15 O5x O 23.6663 -26.3708
16 C1c C 23.4557 -23.2693
17 C1a C 27.7742 -22.1866
18 S2a S 29.6409 -24.6678
19 O6a O 29.2255 -27.4182
20 O6a O 26.9200 -28.1730
21 C1a C 22.2386 -23.9656
22 O1a O 23.4440 -21.8589
23 C8y C 30.8406 -25.3700
24 N5x N 32.0109 -24.6152
25 S2x S 31.2033 -26.7159
26 C8y C 33.0876 -25.4871
27 C8x C 32.5903 -26.7862
28 C1b C 37.9297 -22.6743
29 C5a C 39.1416 -23.3752
30 N1a N 40.3546 -22.6762
31 O5a O 39.1405 -24.7752
BOND 34
1 6 1 2
2 1 2 1
3 7 8 1
4 7 9 1
5 7 10 1
6 8 11 1
7 8 12 1
8 9 13 2
9 9 14 1
10 10 15 2
11 11 16 1
12 12 17 1 #Up
13 13 18 1
14 14 19 1
15 14 20 2
16 16 21 1
17 16 22 1 #Up
18 23 18 1
19 23 24 2
20 23 25 1
21 24 26 1
22 25 27 1
23 26 2 1
24 10 11 1
25 12 13 1
26 26 27 2
27 2 3 2
28 5 28 1
29 3 4 1
30 28 29 1
31 4 5 2
32 29 30 1
33 5 6 1
34 29 31 2
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