ATOM 57
1 C8y C 17.8500 -29.0500
2 C8y C 17.8500 -30.4500
3 C8y C 19.0624 -31.1500
4 C8x C 20.2749 -30.4500
5 C8y C 20.2749 -29.0500
6 C8y C 19.0624 -28.3500
7 C8y C 17.8500 -18.0600
8 C8y C 17.8500 -19.4600
9 C8y C 19.0400 -20.1600
10 C8y C 20.3000 -19.4600
11 C8x C 20.3000 -18.0600
12 C8y C 19.0400 -17.3600
13 C8y C 19.1100 -22.6100
14 C8y C 17.9200 -23.3100
15 C8y C 17.9200 -24.7100
16 C8y C 19.1100 -25.4100
17 C8x C 20.3700 -24.7100
18 C8y C 20.3700 -23.3100
19 C7x C 21.7700 -18.5500
20 O7x O 23.7300 -18.4100
21 C7x C 22.3300 -24.0100
22 O6a O 22.2723 -25.5023
23 O6a O 21.2677 -17.3823
24 C1y C 25.3400 -21.4900
25 C1y C 25.3400 -22.8900
26 C1y C 26.5524 -23.5900
27 C1y C 27.7649 -22.8900
28 O2x O 27.7649 -21.4900
29 C1y C 26.5524 -20.7900
30 C1x C 26.5524 -19.3902
31 O7x O 24.1276 -23.5900
32 O1a O 24.1276 -20.7900
33 O1a O 26.5524 -24.9898
34 O7a O 28.9960 -23.6010
35 C7a C 30.2012 -22.9053
36 C8y C 31.3835 -23.5881
37 C8x C 31.3834 -24.9898
38 C8y C 32.5957 -25.6899
39 C8y C 33.8082 -24.9900
40 C8y C 33.8084 -23.5884
41 C8x C 32.5960 -22.8883
42 O6a O 30.2016 -21.4904
43 O1a O 35.0219 -25.6909
44 O1a O 32.5956 -27.0898
45 O1a O 35.0214 -22.8882
46 O1a O 16.7047 -22.6149
47 O1a O 16.7047 -25.4051
48 O2a O 19.0928 -26.8099
49 O1a O 16.6347 -17.3649
50 O1a O 16.6347 -20.1551
51 O1a O 19.0228 -15.9601
52 O1a O 19.0624 -32.5498
53 C6a C 21.5060 -28.3390
54 O6a O 22.7112 -29.0347
55 O6a O 21.5057 -26.9501
56 O1a O 16.6376 -31.1500
57 O1a O 16.6376 -28.3500
BOND 62
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 7 8 2
8 8 9 1
9 9 10 2
10 10 11 1
11 11 12 2
12 7 12 1
13 9 13 1
14 13 14 2
15 14 15 1
16 15 16 2
17 16 17 1
18 17 18 2
19 13 18 1
20 10 19 1
21 19 20 1
22 18 21 1
23 21 22 2
24 19 23 2
25 24 25 1
26 25 26 1
27 26 27 1
28 27 28 1
29 28 29 1
30 24 29 1
31 29 30 1 #Up
32 25 31 1 #Up
33 24 32 1 #Down
34 26 33 1 #Down
35 21 31 1
36 20 30 1
37 27 34 1 #Up
38 34 35 1
39 35 36 1
40 36 37 2
41 37 38 1
42 38 39 2
43 39 40 1
44 40 41 2
45 36 41 1
46 35 42 2
47 39 43 1
48 38 44 1
49 40 45 1
50 14 46 1
51 15 47 1
52 16 48 1
53 7 49 1
54 8 50 1
55 12 51 1
56 6 48 1
57 3 52 1
58 5 53 1
59 53 54 1
60 53 55 2
61 2 56 1
62 1 57 1
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