ATOM 42
1 C1a C 21.4956 -25.9088
2 C1d C 22.1967 -24.6965
3 C1b C 23.5972 -24.6975
4 C1b C 24.2983 -23.4852
5 C1b C 25.6988 -23.4863
6 C2c C 26.3999 -22.2740
7 C2b C 27.8003 -22.2750
8 C2b C 28.5015 -21.0627
9 C2b C 29.9019 -21.0637
10 C2c C 30.6031 -19.8514
11 C2b C 32.0035 -19.8525
12 C2b C 32.7046 -18.6402
13 C2b C 34.1051 -18.6412
14 C2c C 34.8062 -17.4289
15 C2b C 36.2067 -17.4299
16 O1a O 21.5066 -23.4993
17 C1a C 20.7963 -24.6965
18 C1a C 25.6971 -21.0547
19 C1a C 29.8874 -18.6103
20 C4a C 34.1084 -16.2183
21 C2b C 36.9024 -18.6478
22 C2b C 38.3029 -18.6458
23 C2b C 39.0049 -19.8576
24 C2c C 40.4054 -19.8555
25 C2b C 41.1073 -21.0673
26 C2b C 42.5077 -21.0653
27 C2b C 43.2098 -22.2771
28 C2c C 44.6102 -22.2750
29 C2b C 45.3123 -23.4868
30 C2b C 46.7127 -23.4848
31 C2b C 47.4147 -24.6966
32 C2c C 48.8152 -24.6945
33 C1b C 49.5171 -25.9063
34 C1b C 50.9176 -25.9043
35 C2b C 51.6196 -27.1161
36 C2c C 53.0201 -27.1140
37 C1a C 53.7221 -28.3258
38 C1a C 41.0896 -18.6669
39 C1a C 45.3102 -21.0587
40 C1a C 49.5006 -23.5032
41 C1a C 53.7214 -25.8953
42 O4a O 32.6995 -16.2171
BOND 41
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 6 7 2
7 7 8 1
8 8 9 2
9 9 10 1
10 10 11 2
11 11 12 1
12 12 13 2
13 13 14 1
14 14 15 2
15 2 16 1
16 2 17 1
17 6 18 1
18 10 19 1
19 14 20 1
20 15 21 1
21 21 22 2
22 22 23 1
23 23 24 2
24 24 25 1
25 25 26 2
26 26 27 1
27 27 28 2
28 28 29 1
29 29 30 2
30 30 31 1
31 31 32 2
32 32 33 1
33 33 34 1
34 34 35 1
35 35 36 2
36 36 37 1
37 24 38 1
38 28 39 1
39 32 40 1
40 36 41 1
41 20 42 2
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