ATOM 58
1 C1b C 13.6779 -15.9185
2 C2b C 14.8890 -15.2193
3 C1b C 8.8329 -15.9256
4 C2b C 10.0440 -15.2264
5 C2c C 11.2550 -15.9256
6 C1b C 12.4661 -15.2264
7 C1a C 11.2550 -17.3240
8 C2y C 7.6217 -15.2267
9 C5x C 6.3884 -15.9398
10 C2y C 7.6217 -13.8065
11 C2y C 5.1842 -15.2267
12 O5x O 6.3824 -17.3427
13 C5x C 6.3884 -13.1108
14 C1a C 8.8316 -13.1051
15 C2y C 5.1842 -13.8065
16 O2a O 3.9685 -15.9165
17 O5x O 6.3824 -11.7080
18 O2a O 3.9685 -13.1108
19 C1a C 2.7586 -15.2093
20 C2c C 16.1040 -15.9209
21 C1a C 17.3267 -15.2154
22 C1a C 16.1037 -17.2900
23 C1a C 2.7838 -13.8007
24 C1b C 8.8329 -15.9256
25 C2b C 10.0440 -15.2264
26 C2c C 11.2550 -15.9256
27 C1b C 12.4661 -15.2264
28 C1a C 11.2550 -17.3240
29 C1b C 8.8329 -15.9256
30 C2b C 10.0440 -15.2264
31 C2c C 11.2550 -15.9256
32 C1b C 12.4661 -15.2264
33 C1a C 11.2550 -17.3240
34 C1b C 8.8329 -15.9256
35 C2b C 10.0440 -15.2264
36 C2c C 11.2550 -15.9256
37 C1b C 12.4661 -15.2264
38 C1a C 11.2550 -17.3240
39 C1b C 8.8329 -15.9256
40 C2b C 10.0440 -15.2264
41 C2c C 11.2550 -15.9256
42 C1b C 12.4661 -15.2264
43 C1a C 11.2550 -17.3240
44 C1b C 8.8329 -15.9256
45 C2b C 10.0440 -15.2264
46 C2c C 11.2550 -15.9256
47 C1b C 12.4661 -15.2264
48 C1a C 11.2550 -17.3240
49 C1b C 8.8329 -15.9256
50 C2b C 10.0440 -15.2264
51 C2c C 11.2550 -15.9256
52 C1b C 12.4661 -15.2264
53 C1a C 11.2550 -17.3240
54 C1b C 8.8329 -15.9256
55 C2b C 10.0440 -15.2264
56 C2c C 11.2550 -15.9256
57 C1b C 12.4661 -15.2264
58 C1a C 11.2550 -17.3240
BOND 58
1 1 2 1
2 8 9 1
3 8 10 2
4 9 11 1
5 9 12 2
6 10 13 1
7 10 14 1
8 11 15 2
9 11 16 1
10 13 17 2
11 15 18 1
12 16 19 1
13 13 15 1
14 2 20 2
15 20 21 1
16 20 22 1
17 18 23 1
18 3 4 1
19 4 5 2
20 5 6 1
21 5 7 1
22 6 1 1
23 24 25 1
24 25 26 2
25 26 27 1
26 26 28 1
27 3 27 1
28 29 30 1
29 30 31 2
30 31 32 1
31 31 33 1
32 24 32 1
33 34 35 1
34 35 36 2
35 36 37 1
36 36 38 1
37 29 37 1
38 39 40 1
39 40 41 2
40 41 42 1
41 41 43 1
42 34 42 1
43 44 45 1
44 45 46 2
45 46 47 1
46 46 48 1
47 39 47 1
48 49 50 1
49 50 51 2
50 51 52 1
51 51 53 1
52 44 52 1
53 54 55 1
54 55 56 2
55 56 57 1
56 56 58 1
57 49 57 1
58 54 8 1
BRACKET 1 8.7500 -16.7300 8.7500 -15.0500
1 12.5300 -14.8400 12.5300 -16.6600
1 8
ORIGINAL 1 3 4 5 6 7
REPEAT 1 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39
1 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55
1 56 57 58
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