ATOM 38
1 C8y C 28.8112 -18.1113
2 C8y C 28.8053 -19.5160
3 C8y C 30.0345 -17.4090
4 O2x O 27.5997 -17.3973 #+
5 O2a O 29.9114 -20.1539
6 C8x C 27.5880 -20.2124
7 C8x C 31.2518 -18.1171
8 C8x C 30.0345 -15.9986
9 C8y C 26.3764 -18.0996
10 C1y C 31.2283 -20.9265
11 C8y C 26.3705 -19.5043
12 C8y C 32.4750 -17.4147
13 C8x C 31.2577 -15.2963
14 C8x C 25.1591 -17.3916
15 O2x O 31.2283 -22.3252
16 C1y C 32.4458 -20.2241
17 C8y C 25.1591 -20.2066
18 C8y C 32.4808 -16.0043
19 R R 33.6865 -18.1171
20 C8y C 23.9417 -18.0996
21 C1y C 32.4458 -23.0275
22 C1y C 33.6513 -20.9265
23 O1a O 32.4458 -18.9658
24 C8x C 23.9417 -19.5043
25 O1a O 25.1591 -21.6053
26 O1a O 33.6922 -15.3079
27 O1a O 22.7302 -17.4032
28 C1y C 33.6513 -22.3252
29 C1b C 32.4458 -24.4264
30 O1a O 34.8686 -20.2241
31 O1a O 34.8686 -23.0218
32 O7a O 31.2342 -25.1288
33 C7a C 30.0104 -24.4251
34 C1b C 28.8119 -25.1200
35 O6a O 30.0080 -23.0302
36 C6a C 27.6236 -24.4368
37 O6a O 26.4352 -25.1259
38 O6a O 27.6210 -23.0303
BOND 41
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 1
5 2 6 2
6 3 7 2
7 3 8 1
8 4 9 1
9 10 5 1 #Up
10 6 11 1
11 7 12 1
12 8 13 2
13 9 14 1
14 10 15 1
15 10 16 1
16 11 17 1
17 12 18 2
18 12 19 1
19 14 20 2
20 15 21 1
21 16 22 1
22 16 23 1 #Down
23 17 24 2
24 17 25 1
25 18 26 1
26 20 27 1
27 21 28 1
28 21 29 1 #Up
29 22 30 1 #Up
30 28 31 1 #Down
31 29 32 1
32 9 11 2
33 13 18 1
34 20 24 1
35 22 28 1
36 32 33 1
37 33 34 1
38 33 35 2
39 34 36 1
40 36 37 1
41 36 38 2
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