ATOM 37
1 C1y C 19.1800 -19.7400
2 C1y C 19.1800 -21.1400
3 O2x O 20.3700 -18.9700
4 C1y C 20.3700 -21.8400
5 O1a O 17.9900 -21.8400
6 C1y C 21.5600 -19.7400
7 C1y C 21.5600 -21.1400
8 O1a O 20.3700 -23.2400
9 C1a C 22.8200 -18.9700
10 O1a O 22.8200 -21.8400
11 C1y C 19.1800 -15.4700
12 C1y C 19.1800 -14.0700
13 C1y C 20.3700 -16.1700
14 O2a O 17.9900 -16.1700
15 O2x O 20.3700 -13.3700
16 C1b C 17.9900 -13.3700
17 C1y C 21.5600 -15.4700
18 O1a O 20.3700 -17.5700
19 C1y C 16.7300 -16.8700
20 C1y C 21.5600 -14.0700
21 O1a O 16.8700 -14.2800
22 N1b N 23.0300 -16.4500
23 O2x O 15.5400 -16.1700
24 C1y C 16.7300 -18.3400
25 O2a O 22.7500 -13.3700
26 C1y C 14.3500 -16.8700
27 C1y C 15.5400 -19.0400
28 C1y C 14.3500 -18.3400
29 C1b C 13.0900 -16.1700
30 O1a O 15.5400 -20.3700
31 O1a O 13.0900 -18.9700
32 O1a O 11.9000 -16.8700
33 R R 22.7500 -11.9700
34 C5a C 24.2200 -15.7500
35 C1a C 25.4100 -16.4500
36 O5a O 24.2200 -14.3500
37 O2a O 17.9453 -19.0351
BOND 39
1 1 2 1
2 1 3 1
3 2 4 1
4 2 5 1 #Down
5 3 6 1
6 4 7 1
7 4 8 1 #Up
8 6 9 1 #Up
9 7 10 1 #Up
10 6 7 1
11 11 12 1
12 11 13 1
13 11 14 1 #Down
14 12 15 1
15 12 16 1 #Up
16 13 17 1
17 13 18 1 #Up
18 19 14 1 #Up
19 15 20 1
20 16 21 1
21 17 22 1 #Down
22 19 23 1
23 19 24 1
24 20 25 1 #Up
25 23 26 1
26 24 27 1
27 26 28 1
28 26 29 1 #Up
29 27 30 1 #Up
30 28 31 1 #Up
31 29 32 1
32 17 20 1
33 27 28 1
34 25 33 1
35 22 34 1
36 34 35 1
37 34 36 2
38 24 37 1 #Down
39 1 37 1 #Down
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