ATOM 30
1 C1z C 25.6200 -17.6400
2 C1z C 26.5300 -16.5900
3 C1z C 24.5000 -18.4800
4 C1y C 26.3200 -18.8300
5 C1y C 25.2000 -16.3100
6 C1y C 27.9300 -16.5900
7 C1y C 27.7900 -17.1500
8 C1y C 26.1100 -15.2600
9 C1y C 23.3800 -17.6400
10 O2x O 26.6000 -17.6400
11 C7x C 24.5000 -19.8100
12 C1y C 27.6500 -18.5500
13 O7x O 25.7600 -20.0900
14 C1y C 23.8000 -16.3100
15 O1a O 24.7800 -17.1500
16 O7x O 28.3500 -15.2600
17 C1d C 29.1200 -16.8000
18 C7x C 27.2300 -14.4900
19 O1a O 26.1100 -13.8600
20 C1y C 21.9800 -17.6400
21 O6a O 23.4500 -20.7200
22 O1a O 28.9800 -18.8300
23 O7x O 22.6800 -15.4700
24 C1a C 29.8900 -17.9900
25 C1a C 30.3100 -16.1000
26 C1a C 30.5200 -17.1500
27 O6a O 27.2300 -13.0900
28 C7x C 21.4900 -16.3100
29 C1a C 21.5600 -18.9700
30 O6a O 20.1600 -15.8900
BOND 35
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1
5 2 6 1
6 2 7 1
7 2 8 1
8 3 9 1
9 3 10 1 #Up
10 3 11 1
11 4 12 1
12 4 13 1
13 5 14 1
14 5 15 1 #Down
15 6 16 1
16 7 17 1 #Down
17 8 18 1
18 8 19 1 #Up
19 9 20 1
20 11 21 2
21 12 22 1 #Up
22 14 23 1
23 17 24 1
24 17 25 1
25 17 26 1
26 18 27 2
27 20 28 1
28 20 29 1 #Down
29 28 30 2
30 6 10 1 #Up
31 7 12 1
32 9 14 1
33 11 13 1
34 16 18 1
35 23 28 1
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