ATOM 51
1 C1x C 21.4900 -31.4300
2 C1y C 21.4900 -32.8300
3 C1x C 22.6800 -33.5300
4 C2y C 23.9400 -32.8300
5 C1z C 23.9400 -31.4300
6 C1y C 22.6800 -30.7300
7 C2x C 25.1300 -33.5300
8 C1x C 26.3200 -32.8300
9 C1y C 26.3200 -31.4300
10 C1y C 25.1300 -30.7300
11 C1y C 27.5800 -30.7300
12 C1z C 27.5800 -29.3300
13 C1x C 26.3200 -28.6300
14 C1x C 25.1300 -29.3300
15 C1x C 29.9600 -30.7300
16 C1y C 29.9600 -29.3300
17 C1y C 28.7700 -28.6300
18 O2x O 31.2200 -28.6300
19 C1z C 31.2200 -27.2300
20 C1y C 28.7700 -27.2300
21 O2x O 32.4100 -27.9300
22 C1x C 33.6000 -27.2300
23 C1y C 33.6000 -25.8300
24 C1x C 32.4100 -25.1300
25 C1x C 31.2200 -25.8300
26 C1a C 34.7900 -25.1300
27 C1a C 27.7900 -26.2500
28 C1a C 27.5800 -27.9300
29 C1a C 23.9400 -30.0300
30 O1a O 20.3000 -33.5300
31 O2a O 22.6800 -29.3300
32 C1y C 22.6800 -28.0000
33 C1y C 21.4900 -25.9000
34 C1y C 21.4900 -27.3000
35 O2x O 23.9400 -27.3000
36 C1y C 23.9400 -25.9000
37 C1y C 22.6800 -25.2000
38 C1a C 25.1300 -25.2000
39 O1a O 22.6800 -23.8000
40 O1a O 20.3000 -25.2000
41 O2a O 20.3000 -28.0000
42 C1y C 19.0400 -28.6300
43 C1y C 16.5900 -28.6300
44 C1y C 16.5900 -30.0300
45 C1y C 17.7800 -30.7300
46 O2x O 19.0400 -30.0300
47 C1y C 17.7800 -27.9300
48 C1a C 17.7800 -32.1300
49 O1a O 15.4000 -30.7300
50 O1a O 15.4000 -27.9300
51 O1a O 17.7800 -26.5300
BOND 58
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 4 7 2
8 7 8 1
9 8 9 1
10 9 10 1
11 5 10 1
12 9 11 1
13 11 12 1
14 12 13 1
15 13 14 1
16 10 14 1
17 11 15 1
18 15 16 1
19 16 17 1
20 12 17 1
21 16 18 1
22 18 19 1
23 19 20 1
24 17 20 1
25 19 21 1 #Down
26 21 22 1
27 22 23 1
28 23 24 1
29 24 25 1
30 19 25 1 #Up
31 23 26 1 #Up
32 20 27 1 #Down
33 12 28 1 #Up
34 5 29 1 #Up
35 2 30 1 #Up
36 6 31 1 #Up
37 32 31 1 #Up
38 33 34 1
39 34 32 1
40 32 35 1
41 35 36 1
42 36 37 1
43 33 37 1
44 36 38 1 #Up
45 37 39 1 #Up
46 33 40 1 #Up
47 34 41 1 #Down
48 42 41 1 #Down
49 43 44 1
50 44 45 1
51 45 46 1
52 46 42 1
53 42 47 1
54 43 47 1
55 45 48 1 #Up
56 44 49 1 #Down
57 43 50 1 #Up
58 47 51 1 #Up
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