ATOM 30
1 C1x C 29.8200 -17.2900
2 O2x O 30.1700 -16.3800
3 C7a C 27.0200 -20.6500
4 O7a O 28.4200 -19.8100
5 C1a C 27.0200 -22.0500
6 O6a O 25.8300 -19.9500
7 O1a O 33.9500 -18.6900
8 C1z C 31.3600 -17.2900
9 C1z C 30.2400 -17.9900
10 C1y C 31.3600 -16.0300
11 C1z C 29.0500 -17.2900
12 C1y C 32.6900 -17.9900
13 C1a C 30.2400 -19.3200
14 C1y C 32.6900 -16.0300
15 O2x O 30.2400 -15.3300
16 C1y C 29.0500 -15.9600
17 C1x C 27.9300 -17.9900
18 C1b C 29.0500 -18.6200
19 O1a O 33.6700 -15.0500
20 C2x C 27.9300 -15.3300
21 C1y C 26.7400 -17.2900
22 C2y C 26.7400 -15.9600
23 O7a O 25.6200 -17.9900
24 C1a C 25.6200 -15.3300
25 C7a C 24.4300 -17.3600
26 C1b C 23.3100 -17.9900
27 O6a O 24.4300 -15.9600
28 C1c C 22.1200 -17.3600
29 C1a C 21.0000 -17.9900
30 C1a C 22.1200 -16.0300
BOND 33
1 3 4 1
2 3 5 1
3 1 2 1
4 3 6 2
5 8 9 1
6 8 10 1
7 8 2 1 #Down
8 9 11 1
9 9 12 1
10 9 13 1 #Up
11 10 14 1
12 10 15 1
13 11 16 1
14 11 17 1
15 11 18 1 #Down
16 14 19 1 #Down
17 16 20 1
18 17 21 1
19 18 4 1
20 20 22 2
21 21 23 1 #Down
22 22 24 1
23 23 25 1
24 25 26 1
25 25 27 2
26 26 28 1
27 28 29 1
28 28 30 1
29 12 14 1
30 15 16 1
31 21 22 1
32 12 7 1 #Up
33 8 1 1
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