ATOM 32
1 C8x C 13.8600 -15.6800
2 C8x C 13.8600 -17.0800
3 C8x C 15.0500 -17.7100
4 C8y C 16.2400 -17.0800
5 C8y C 16.2400 -15.6800
6 C8x C 15.0500 -14.9800
7 N4x N 17.5700 -17.5000
8 C8y C 18.4100 -16.3800
9 C8y C 17.5700 -15.2600
10 C1z C 19.6700 -15.9600
11 C1y C 19.6700 -14.5600
12 C1x C 18.4100 -14.1400
13 C1z C 20.9300 -16.5900
14 C1z C 22.1200 -15.9600
15 C1x C 22.1200 -14.5600
16 C1x C 20.9300 -13.8600
17 C1x C 20.9300 -17.9900
18 C1x C 22.1200 -18.6900
19 C1y C 23.3100 -17.9900
20 C2y C 23.3100 -16.5900
21 O2x O 24.5000 -18.6900
22 C1y C 25.6900 -17.9900
23 C1y C 25.6900 -16.5900
24 C2x C 24.5000 -15.9600
25 C1a C 19.7400 -17.3600
26 O1a O 23.3100 -15.2600
27 C1d C 26.9500 -18.6900
28 C1a C 20.3700 -15.1200
29 O1a O 26.9500 -15.8900
30 O1a O 28.1400 -17.9900
31 C1a C 26.9500 -20.3000
32 C1a C 28.1400 -19.3900
BOND 37
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 4 7 1
8 7 8 1
9 8 9 2
10 5 9 1
11 8 10 1
12 10 11 1
13 11 12 1
14 9 12 1
15 10 13 1
16 13 14 1
17 14 15 1
18 15 16 1
19 11 16 1
20 13 17 1
21 17 18 1
22 18 19 1
23 19 20 1
24 14 20 1
25 19 21 1
26 21 22 1
27 22 23 1
28 23 24 1
29 20 24 2
30 10 25 1 #Down
31 14 26 1 #Down
32 22 27 1 #Up
33 13 28 1 #Up
34 23 29 1 #Up
35 27 30 1
36 27 31 1
37 27 32 1
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