ATOM 18
1 C8y C 26.5888 -18.2439
2 C8y C 25.6709 -17.2267
3 C1y C 27.9393 -17.9574
4 N4x N 25.9049 -19.4307
5 C8y C 24.4256 -17.7879
6 C1x C 26.1093 -15.8995
7 N1y N 28.3777 -16.6479
8 C2b C 28.8921 -19.0331
9 C8y C 24.4607 -19.1501
10 C8x C 23.2038 -17.1214
11 C1x C 27.4656 -15.6247
12 C1a C 29.7983 -16.0697
13 C2c C 30.3128 -19.0149
14 C8x C 23.2740 -19.8749
15 C8x C 22.0287 -17.8521
16 C1a C 31.2656 -20.1023
17 C1a C 31.0259 -17.7522
18 C8x C 22.0638 -19.2201
BOND 20
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 1
9 5 10 1
10 6 11 1
11 7 12 1
12 8 13 2
13 9 14 1
14 10 15 2
15 13 16 1
16 13 17 1
17 14 18 2
18 5 9 2
19 7 11 1
20 15 18 1
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