ATOM 49
1 C1b C 16.4311 -19.6401
2 C2b C 17.7107 -18.9912
3 C2c C 19.0045 -19.6401
4 C1a C 20.2842 -18.9912
5 C1a C 19.0045 -20.9446
6 C1b C 11.3116 -19.6401
7 C2b C 12.5914 -18.9912
8 C2c C 13.8639 -19.6401
9 C1b C 15.1508 -18.9912
10 C1a C 13.8639 -20.9446
11 C8y C 10.0270 -19.0054
12 C8y C 8.8738 -19.6883
13 C8x C 10.0270 -17.6598
14 C8y C 7.7034 -19.0054
15 O1a O 8.8738 -21.0339
16 C8x C 8.8738 -16.9911
17 C8x C 7.7034 -17.6598
18 O2a O 6.5025 -19.7000
19 C1a C 5.2956 -18.9997
20 C1b C 11.3116 -19.6401
21 C2b C 12.5914 -18.9912
22 C2c C 13.8639 -19.6401
23 C1b C 15.1508 -18.9912
24 C1a C 13.8639 -20.9446
25 C1b C 11.3116 -19.6401
26 C2b C 12.5914 -18.9912
27 C2c C 13.8639 -19.6401
28 C1b C 15.1508 -18.9912
29 C1a C 13.8639 -20.9446
30 C1b C 11.3116 -19.6401
31 C2b C 12.5914 -18.9912
32 C2c C 13.8639 -19.6401
33 C1b C 15.1508 -18.9912
34 C1a C 13.8639 -20.9446
35 C1b C 11.3116 -19.6401
36 C2b C 12.5914 -18.9912
37 C2c C 13.8639 -19.6401
38 C1b C 15.1508 -18.9912
39 C1a C 13.8639 -20.9446
40 C1b C 11.3116 -19.6401
41 C2b C 12.5914 -18.9912
42 C2c C 13.8639 -19.6401
43 C1b C 15.1508 -18.9912
44 C1a C 13.8639 -20.9446
45 C1b C 11.3116 -19.6401
46 C2b C 12.5914 -18.9912
47 C2c C 13.8639 -19.6401
48 C1b C 15.1508 -18.9912
49 C1a C 13.8639 -20.9446
BOND 49
1 1 2 1
2 2 3 2
3 3 4 1
4 3 5 1
5 11 12 2
6 11 13 1
7 12 14 1
8 12 15 1
9 13 16 2
10 14 17 2
11 14 18 1
12 18 19 1
13 16 17 1
14 6 7 1
15 7 8 2
16 8 9 1
17 8 10 1
18 9 1 1
19 20 21 1
20 21 22 2
21 22 23 1
22 22 24 1
23 6 23 1
24 25 26 1
25 26 27 2
26 27 28 1
27 27 29 1
28 20 28 1
29 30 31 1
30 31 32 2
31 32 33 1
32 32 34 1
33 25 33 1
34 35 36 1
35 36 37 2
36 37 38 1
37 37 39 1
38 30 38 1
39 40 41 1
40 41 42 2
41 42 43 1
42 42 44 1
43 35 43 1
44 45 46 1
45 46 47 2
46 47 48 1
47 47 49 1
48 40 48 1
49 45 11 1
BRACKET 1 10.8500 -20.4400 10.8500 -18.3400
1 15.5400 -18.4800 15.5400 -20.5800
1 7
ORIGINAL 1 6 7 8 9 10
REPEAT 1 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35
1 36 37 38 39 40 41 42 43 44 45 46 47 48 49
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