ATOM 19
1 C8x C 28.4200 -18.1300
2 C8x C 28.4200 -19.5300
3 C8x C 29.6100 -20.2300
4 C8x C 30.8700 -19.5300
5 C8y C 30.8700 -18.1300
6 C8x C 29.6100 -17.4300
7 C8x C 33.2500 -19.5300
8 C8y C 33.2500 -18.1300
9 C1z C 32.0600 -17.4300
10 C8x C 34.5100 -20.2300
11 C8x C 35.7000 -19.5300
12 C8x C 35.7000 -18.1300
13 C8x C 34.5100 -17.4300
14 N1x N 33.1800 -16.5900
15 C2y C 32.6900 -15.2600
16 N2x N 31.2900 -15.2600
17 C5x C 30.9400 -16.5900
18 O1a O 33.4600 -14.0700
19 O5x O 29.5400 -16.5900
BOND 21
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 7 8 1
8 8 9 1
9 5 9 1
10 7 10 2
11 10 11 1
12 11 12 2
13 12 13 1
14 8 13 2
15 9 14 1
16 14 15 1
17 15 16 2
18 16 17 1
19 9 17 1
20 15 18 1
21 17 19 2
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