ATOM 41
1 C1y C 15.1200 -19.8100
2 O2x O 15.1200 -18.4100
3 C1y C 13.9300 -17.7100
4 C1y C 12.6700 -18.4100
5 C1y C 12.6700 -19.8100
6 C1y C 13.9300 -20.5100
7 C1y C 23.3800 -17.7800
8 C1y C 22.1900 -18.4800
9 C1z C 23.3800 -16.4500
10 C1x C 25.6900 -17.7800
11 C1y C 21.0000 -17.7800
12 C1x C 22.1900 -19.8100
13 C1y C 24.5700 -15.7500
14 C1x C 22.1900 -15.7500
15 C1a C 23.3800 -15.1200
16 C1x C 25.6900 -16.4500
17 C1z C 19.8100 -18.4800
18 C1x C 21.0000 -16.4500
19 C2x C 21.0000 -20.5100
20 C1c C 24.5700 -14.4200
21 C2y C 19.8100 -19.8100
22 C1x C 18.6900 -17.7800
23 C1a C 19.8100 -17.1500
24 C1b C 25.7600 -13.7200
25 C1a C 23.3100 -13.7200
26 C1x C 18.6900 -20.5100
27 C1x C 17.5000 -18.4800
28 C1b C 26.9500 -14.4200
29 C1y C 17.5000 -19.8100
30 C1c C 28.1400 -13.7200
31 O2a O 16.3100 -20.5100
32 C1c C 29.3300 -14.4200
33 C1a C 30.5200 -13.7200
34 C1a C 29.3300 -16.1000
35 C1b C 28.1400 -12.3200
36 C1a C 29.3300 -11.6200
37 C1b C 13.9300 -16.3100
38 O1a O 11.4800 -20.5100
39 O1a O 11.4800 -17.7100
40 O1a O 13.8600 -21.9100
41 O1a O 12.7400 -15.6100
BOND 45
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 7 8 1
8 7 9 1
9 7 10 1
10 8 11 1
11 8 12 1
12 9 13 1
13 9 14 1
14 9 15 1 #Up
15 10 16 1
16 11 17 1
17 11 18 1
18 12 19 1
19 13 20 1
20 17 21 1
21 17 22 1
22 17 23 1 #Up
23 20 24 1
24 20 25 1 #Down
25 21 26 1
26 22 27 1
27 24 28 1
28 26 29 1
29 28 30 1
30 29 31 1 #Up
31 30 32 1
32 32 33 1
33 32 34 1
34 13 16 1
35 14 18 1
36 19 21 2
37 27 29 1
38 30 35 1 #Up
39 35 36 1
40 1 31 1 #Up
41 3 37 1 #Up
42 5 38 1 #Up
43 4 39 1 #Down
44 6 40 1 #Down
45 37 41 1
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