ATOM 40
1 C8y C 20.7177 -18.4969
2 C8x C 20.7177 -19.8962
3 C8x C 21.9297 -20.5959
4 C8y C 23.1415 -19.8962
5 C8x C 23.1415 -18.4969
6 C8x C 21.9297 -17.7972
7 C5a C 24.3547 -20.5966
8 N1c N 25.5680 -19.8962
9 O5a O 24.3547 -21.9953
10 C8y C 26.7805 -20.5963
11 C8x C 26.7805 -21.9953
12 C8x C 27.9924 -22.6949
13 C8y C 29.2042 -21.9953
14 C8y C 29.2042 -20.5963
15 C8x C 27.9924 -19.8966
16 C1b C 25.5680 -18.4969
17 C1b C 26.7805 -17.7968
18 C1b C 27.9934 -18.4971
19 N1c N 29.2061 -17.7969
20 C1b C 30.4190 -18.4971
21 C1a C 29.2061 -16.3978
22 C1b C 31.6317 -17.7969
23 C8y C 32.8444 -18.4971
24 C8x C 32.8444 -19.8962
25 C8x C 34.0564 -20.5959
26 C8y C 35.2682 -19.8962
27 C8y C 35.2682 -18.4971
28 C8x C 34.0564 -17.7974
29 O2a O 36.4824 -17.7961
30 O2a O 36.4823 -20.5971
31 C1a C 37.6958 -19.8964
32 C1a C 37.6958 -18.4967
33 N2b N 19.5059 -17.7972
34 O2a O 30.4185 -19.8952
35 O2a O 30.4184 -22.6961
36 C1a C 31.6320 -21.9955
37 C1a C 31.6319 -20.5958
38 O3a O 18.2933 -18.4973
39 O3a O 19.5059 -16.3978
40 X Cl 35.5133 -22.4233
BOND 41
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 4 7 1
8 7 8 1
9 7 9 2
10 8 10 1
11 10 11 2
12 11 12 1
13 12 13 2
14 13 14 1
15 14 15 2
16 10 15 1
17 8 16 1
18 16 17 1
19 17 18 1
20 18 19 1
21 19 20 1
22 19 21 1
23 20 22 1
24 22 23 1
25 23 24 2
26 24 25 1
27 25 26 2
28 26 27 1
29 27 28 2
30 23 28 1
31 27 29 1
32 26 30 1
33 30 31 1
34 29 32 1
35 1 33 1
36 14 34 1
37 13 35 1
38 35 36 1
39 34 37 1
40 33 38 2
41 33 39 2
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