ATOM 59
1 C8x C 6.5100 -15.4700
2 C8x C 6.5100 -16.8700
3 C8x C 7.7000 -17.5700
4 C8y C 8.9600 -16.8700
5 C8y C 8.9600 -15.4700
6 C8x C 7.7000 -14.7700
7 C5x C 10.1500 -17.5700
8 C2y C 11.3400 -16.8700
9 C2y C 11.3400 -15.4700
10 C5x C 10.1500 -14.7700
11 C1a C 12.6000 -14.7700
12 O5x O 10.1500 -13.3700
13 O5x O 10.1500 -18.9700
14 C1b C 12.6000 -17.5700
15 C1a C 14.9800 -18.9700
16 C2c C 14.9800 -17.5700
17 C2b C 13.7900 -16.8700
18 C1b C 17.4300 -17.5700
19 C1b C 16.2400 -16.8700
20 C1c C 19.8800 -17.5700
21 C1b C 18.6200 -16.8700
22 C1a C 19.8800 -18.9700
23 C1b C 22.2600 -17.5700
24 C1b C 21.0700 -16.8700
25 C1a C 24.7100 -18.9700
26 C2c C 24.7100 -17.5700
27 C2b C 23.4500 -16.8700
28 C1b C 27.0900 -17.5700
29 C1b C 25.9000 -16.8700
30 C1a C 29.5400 -18.9700
31 C2c C 29.5400 -17.5700
32 C2b C 28.3500 -16.8700
33 C1b C 30.7300 -16.8700
34 O1a O 31.9424 -17.5700
35 C1b C 22.2600 -17.5700
36 C1a C 24.7100 -18.9700
37 C2c C 24.7100 -17.5700
38 C2b C 23.4500 -16.8700
39 C1b C 25.9000 -16.8700
40 C1b C 22.2600 -17.5700
41 C1a C 24.7100 -18.9700
42 C2c C 24.7100 -17.5700
43 C2b C 23.4500 -16.8700
44 C1b C 25.9000 -16.8700
45 C1b C 22.2600 -17.5700
46 C1a C 24.7100 -18.9700
47 C2c C 24.7100 -17.5700
48 C2b C 23.4500 -16.8700
49 C1b C 25.9000 -16.8700
50 C1b C 22.2600 -17.5700
51 C1a C 24.7100 -18.9700
52 C2c C 24.7100 -17.5700
53 C2b C 23.4500 -16.8700
54 C1b C 25.9000 -16.8700
55 C1b C 22.2600 -17.5700
56 C1a C 24.7100 -18.9700
57 C2c C 24.7100 -17.5700
58 C2b C 23.4500 -16.8700
59 C1b C 25.9000 -16.8700
BOND 60
1 1 2 1
2 2 3 2
3 3 4 1
4 4 5 2
5 5 6 1
6 1 6 2
7 4 7 1
8 7 8 1
9 8 9 2
10 9 10 1
11 5 10 1
12 9 11 1
13 10 12 2
14 7 13 2
15 8 14 1
16 15 16 1
17 16 17 2
18 14 17 1
19 18 19 1
20 16 19 1
21 20 21 1
22 18 21 1
23 20 22 1
24 20 24 1
25 30 31 1
26 31 32 2
27 28 32 1
28 31 33 1
29 33 34 1
30 23 24 1
31 25 26 1
32 26 27 2
33 23 27 1
34 26 29 1
35 29 35 1
36 36 37 1
37 37 38 2
38 35 38 1
39 37 39 1
40 39 40 1
41 41 42 1
42 42 43 2
43 40 43 1
44 42 44 1
45 44 45 1
46 46 47 1
47 47 48 2
48 45 48 1
49 47 49 1
50 49 50 1
51 51 52 1
52 52 53 2
53 50 53 1
54 52 54 1
55 54 55 1
56 56 57 1
57 57 58 2
58 55 58 1
59 57 59 1
60 59 28 1
BRACKET 1 21.8400 -18.6900 21.8400 -16.3100
1 26.6000 -16.3100 26.6000 -18.6900
1 6
ORIGINAL 1 23 25 26 27 29
REPEAT 1 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50
1 51 52 53 54 55 56 57 58 59
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