ATOM 30
1 C8x C 15.9600 -27.4400
2 C8x C 15.9600 -28.8400
3 C8x C 17.1500 -29.5400
4 C8x C 18.4100 -28.8400
5 C8y C 18.4100 -27.4400
6 C8x C 17.1500 -26.7400
7 N1c N 19.6000 -26.7400
8 C1z C 20.8600 -27.4400
9 C1x C 20.8600 -28.8400
10 C1x C 22.0500 -29.5400
11 N1y N 23.2400 -28.8400
12 C1x C 23.2400 -27.4400
13 C1x C 22.0500 -26.7400
14 C1b C 24.5000 -29.5400
15 C1b C 25.6900 -28.8400
16 N4y N 26.8800 -29.5400
17 N5x N 27.2300 -30.8700
18 N5x N 28.6300 -30.8700
19 N4y N 29.1200 -29.6100
20 C8y C 28.0000 -28.7700
21 C5a C 19.6000 -25.3400
22 O5a O 18.4100 -24.6400
23 C1b C 20.8600 -24.6400
24 C1a C 22.0500 -25.3400
25 C1b C 19.6000 -28.1400
26 O2a O 19.6000 -29.5400
27 C1a C 18.4100 -30.2400
28 O5x O 28.0000 -27.3700
29 C1b C 30.3100 -28.9100
30 C1a C 31.5000 -29.6100
BOND 32
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 5 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 10 11 1
12 11 12 1
13 12 13 1
14 8 13 1
15 11 14 1
16 14 15 1
17 15 16 1
18 16 17 1
19 17 18 2
20 18 19 1
21 19 20 1
22 16 20 1
23 7 21 1
24 21 22 2
25 21 23 1
26 23 24 1
27 8 25 1
28 25 26 1
29 26 27 1
30 20 28 2
31 29 30 1
32 29 19 1
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