ATOM 29
1 C8y C 16.5900 -15.8200
2 C8y C 16.5900 -17.1500
3 C8x C 14.2800 -15.8900
4 C8x C 14.2800 -17.2200
5 C8x C 15.4700 -17.8500
6 C8x C 15.4000 -15.1900
7 C1y C 19.9500 -16.3100
8 C1y C 20.4400 -15.1200
9 C1x C 19.6700 -14.0700
10 C1y C 18.3400 -14.2100
11 N1y N 17.3600 -13.3000
12 C1x C 16.2400 -14.0000
13 C1x C 16.5200 -15.2600
14 C1x C 18.2000 -12.2500
15 C2y C 21.2100 -14.0000
16 C1y C 18.6200 -16.5200
17 C1z C 17.8500 -15.4000
18 N1y N 17.8500 -17.5700
19 C2x C 22.4700 -14.7700
20 C1x C 22.9600 -15.9600
21 C1y C 20.7900 -17.4300
22 O1a O 20.7900 -19.3900
23 O2x O 22.6100 -17.5700
24 C5a C 17.8500 -18.9700
25 C1b C 16.6600 -19.6700
26 O5a O 19.0400 -19.6700
27 C6a C 16.6714 -21.0700
28 O6a O 17.8808 -21.7552
29 O6a O 15.4562 -21.7848
BOND 34
1 10 11 1
2 11 12 1
3 12 13 1
4 17 13 1 #Up
5 11 14 1
6 1 2 2
7 8 15 1
8 14 15 1
9 3 4 1
10 16 7 1
11 7 8 1
12 8 9 1
13 9 10 1
14 4 5 2
15 5 2 1
16 16 17 1
17 17 1 1
18 2 18 1
19 18 16 1
20 1 6 1
21 15 19 2
22 6 3 2
23 19 20 1
24 17 10 1
25 7 21 1
26 21 22 1 #Up
27 20 23 1
28 21 23 1
29 18 24 1
30 24 25 1
31 24 26 2
32 25 27 1
33 27 28 2
34 27 29 1
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