ATOM 50
1 C1y C 21.3500 -19.7400
2 O2x O 20.1600 -18.9700
3 C1y C 21.3500 -21.0700
4 C1y C 18.9700 -19.6700
5 C1y C 20.1600 -21.7700
6 O1a O 22.6100 -21.7700
7 C1y C 18.9700 -21.0700
8 C1b C 17.7800 -18.9700
9 O1a O 20.1600 -23.1700
10 O1a O 17.7800 -21.7700
11 C1y C 26.1800 -16.8700
12 C1x C 26.1800 -18.2700
13 O2x O 24.9900 -16.2400
14 C1y C 24.9900 -18.9700
15 C1y C 23.8000 -16.9400
16 C1y C 23.8000 -18.2700
17 O2a O 24.9900 -20.3700
18 C1a C 22.5400 -16.2400
19 O2a O 22.6100 -18.9700
20 C1z C 31.0100 -14.1400
21 C1y C 32.2000 -13.4400
22 C1z C 31.0100 -15.5400
23 C1x C 29.8200 -13.4400
24 C4a C 31.0100 -12.7400
25 C1y C 33.3900 -14.1400
26 C1x C 32.2000 -12.0400
27 C1x C 32.2000 -16.2400
28 C1x C 29.8200 -16.2400
29 O1a O 31.0100 -16.8700
30 C1x C 28.6300 -14.1400
31 O4a O 29.8200 -12.0400
32 C1z C 34.5800 -13.4400
33 C1x C 33.3900 -15.5400
34 C1x C 33.4600 -11.4100
35 C1y C 28.6300 -15.5400
36 C1z C 34.5800 -12.1100
37 C1x C 36.9600 -13.5100
38 O1a O 34.5800 -14.8400
39 O2a O 27.4400 -16.2400
40 C1y C 35.8400 -11.4100
41 C1a C 34.5800 -10.7100
42 C1x C 37.0300 -12.1100
43 C2y C 35.8400 -10.0100
44 C1x C 35.4200 -8.6800
45 C2x C 37.2400 -10.0100
46 O7x O 36.5400 -7.9100
47 C7x C 37.6600 -8.6800
48 O6a O 38.9900 -8.2600
49 O1a O 16.5900 -19.6700
50 C1a C 26.2024 -21.0700
BOND 56
1 5 9 1 #Up
2 7 10 1 #Down
3 5 7 1
4 1 2 1
5 1 3 1
6 2 4 1
7 3 5 1
8 3 6 1 #Down
9 11 12 1
10 11 13 1
11 12 14 1
12 13 15 1
13 14 16 1
14 14 17 1 #Down
15 15 18 1 #Up
16 16 19 1 #Down
17 15 16 1
18 4 7 1
19 1 19 1 #Up
20 20 21 1
21 20 22 1
22 20 23 1
23 20 24 1 #Up
24 21 25 1
25 21 26 1
26 22 27 1
27 22 28 1
28 22 29 1 #Up
29 23 30 1
30 24 31 2
31 25 32 1
32 25 33 1
33 26 34 1
34 28 35 1
35 32 36 1
36 32 37 1
37 32 38 1 #Up
38 35 39 1 #Up
39 36 40 1
40 36 41 1 #Up
41 37 42 1
42 40 43 1
43 43 44 1
44 43 45 2
45 44 46 1
46 45 47 1
47 47 48 2
48 27 33 1
49 30 35 1
50 34 36 1
51 40 42 1
52 46 47 1
53 11 39 1 #Up
54 4 8 1 #Up
55 8 49 1
56 17 50 1
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