ATOM 53
1 C8y C 9.7300 -17.0100
2 C8x C 9.7300 -18.4100
3 C8x C 10.9200 -19.1100
4 C8y C 12.1800 -18.4100
5 C8x C 12.1800 -17.0100
6 C8x C 10.9200 -16.3100
7 O1a O 8.5400 -16.3100
8 C2c C 13.3700 -19.1100
9 C2y C 14.6300 -18.4100
10 C6a C 13.3700 -20.5100
11 O6a O 14.5600 -21.2100
12 O6a O 12.1800 -21.2100
13 C2y C 16.0300 -18.4100
14 C2y C 16.4500 -17.0800
15 C7x C 15.3300 -16.2400
16 O7x O 14.1400 -17.0800
17 O6a O 15.3300 -14.8400
18 O1a O 16.8700 -19.5300
19 C2y C 17.7800 -16.6600
20 C1y C 19.1800 -16.6600
21 C1z C 19.6700 -15.3300
22 C5x C 18.5500 -14.4900
23 C2x C 17.3600 -15.2600
24 C1y C 20.3000 -17.5000
25 C1z C 21.4900 -16.7300
26 C1y C 21.0700 -15.4000
27 C7x C 20.7200 -18.9000
28 O7x O 22.1200 -18.9000
29 C1y C 22.6100 -17.5700
30 O5x O 18.5500 -13.0900
31 O6a O 19.8800 -20.0200
32 C5x C 22.2600 -14.7000
33 C1x C 23.5900 -16.5900
34 C2y C 24.6400 -14.4900
35 C7x C 26.0400 -14.4900
36 O7x O 26.4600 -13.1600
37 C2y C 25.3400 -12.3200
38 C2y C 24.2200 -13.0900
39 O1a O 22.8900 -12.6700
40 C2c C 25.3400 -10.9900
41 C8y C 26.5300 -10.2900
42 C8x C 27.7900 -10.9200
43 C8x C 28.9800 -10.2200
44 C8y C 28.9800 -8.8200
45 C8x C 27.7200 -8.1200
46 C8x C 26.5300 -8.8900
47 O6a O 26.8800 -15.6100
48 O1a O 30.1700 -8.1200
49 C6a C 24.2200 -10.1500
50 O6a O 24.2200 -8.7500
51 O6a O 22.9600 -10.9900
52 O1a O 20.1458 -14.0133
53 O5x O 22.4159 -13.7516
BOND 60
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 1 7 1
8 4 8 1
9 8 9 2
10 8 10 1
11 10 11 1
12 10 12 2
13 9 13 1
14 13 14 2
15 14 15 1
16 15 16 1
17 9 16 1
18 15 17 2
19 13 18 1
20 14 19 1
21 19 20 1
22 20 21 1
23 21 22 1
24 22 23 1
25 19 23 2
26 20 24 1
27 24 25 1
28 25 26 1
29 21 26 1
30 24 27 1
31 27 28 1
32 28 29 1
33 25 29 1
34 22 30 2
35 27 31 2
36 26 32 1
37 29 33 1
38 32 33 1
39 34 35 1
40 35 36 1
41 36 37 1
42 37 38 1
43 34 38 2
44 38 39 1
45 37 40 2
46 40 41 1
47 41 42 2
48 42 43 1
49 43 44 2
50 44 45 1
51 45 46 2
52 41 46 1
53 35 47 2
54 44 48 1
55 40 49 1
56 49 50 2
57 49 51 1
58 25 34 1 #Up
59 21 52 1 #Down
60 32 53 2
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