ATOM 28
1 C1y C 33.3280 -17.8187
2 N1y N 33.3280 -19.2161
3 C2y C 34.5159 -19.9149
4 C2y C 35.7038 -19.2161
5 C1x C 35.7038 -17.8187
6 S2x S 34.5159 -17.1199
7 C1y C 31.9305 -17.8187
8 C5x C 31.9305 -19.2161
9 N1b N 30.6726 -17.1199
10 C5a C 29.4847 -17.8187
11 O5a O 29.4847 -19.2161
12 O5x O 30.6726 -19.9149
13 C2c C 28.2968 -17.1199
14 C1b C 36.9617 -19.9149
15 C8y C 27.0389 -17.8187
16 C8x C 25.9907 -16.9800
17 S2x S 24.8029 -17.7487
18 C8y C 25.2222 -19.1462
19 N5x N 26.6196 -19.1462
20 N2b N 28.2968 -15.7221
21 N1a N 24.3836 -20.2642
22 O2a O 38.1579 -19.1978
23 C1a C 39.3764 -19.8748
24 C6a C 34.5158 -21.3518
25 O6a O 33.2892 -22.0599
26 O6a O 35.7515 -22.0654
27 O2a O 29.4874 -15.0414
28 C1a C 29.4874 -13.6414
BOND 30
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 15 16 2
18 16 17 1
19 17 18 1
20 18 19 2
21 15 19 1
22 13 20 2
23 18 21 1
24 14 22 1
25 22 23 1
26 3 24 1
27 24 25 2
28 24 26 1
29 20 27 1
30 27 28 1
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