ATOM 40
1 C1y C 30.1700 -21.3500
2 C1y C 30.5900 -22.6100
3 C1y C 31.9900 -22.6100
4 C1y C 32.4100 -21.2800
5 O2x O 31.2900 -20.4400
6 O2b O 29.8200 -23.8000
7 C1y C 26.0400 -16.5200
8 C1y C 26.4600 -17.7800
9 C1y C 27.8600 -17.7800
10 C1y C 28.2800 -16.4500
11 O2x O 27.1600 -15.6100
12 R R 29.6100 -15.9600
13 O2b O 25.6900 -18.9700
14 P1b P 25.6900 -20.3700
15 O1c O 24.2900 -20.3700
16 O1c O 25.6900 -21.7700
17 C1y C 21.6300 -11.6200
18 C1y C 22.0500 -12.8800
19 C1y C 23.4500 -12.8800
20 C1y C 23.8700 -11.5500
21 O2x O 22.7500 -10.7100
22 R R 25.2000 -11.0600
23 C1b C 20.3000 -11.2000
24 O1a O 19.3200 -12.1800
25 O2b O 21.2800 -14.0700
26 P1b P 21.2800 -15.4700
27 O1c O 19.8800 -15.4700
28 O1c O 21.2800 -16.8700
29 O2b O 22.6800 -15.4700
30 C1b C 24.9200 -15.4700
31 O2b O 27.0900 -20.3700
32 C1b C 28.7700 -20.3700
33 R R 33.7400 -20.8600
34 O1a O 24.2900 -14.0000
35 O1a O 28.7000 -18.9000
36 O1a O 32.8300 -23.7300
37 P1b P 28.4200 -23.8000
38 O1c O 27.0200 -23.8000
39 O1c O 28.4200 -22.4000
40 O1c O 28.4200 -25.2000
BOND 42
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 1 5 1
6 2 6 1 #Down
7 7 8 1
8 8 9 1
9 9 10 1
10 10 11 1
11 7 11 1
12 10 12 1 #Up
13 8 13 1 #Down
14 13 14 1
15 14 15 1
16 14 16 2
17 17 18 1
18 18 19 1
19 19 20 1
20 20 21 1
21 17 21 1
22 20 22 1 #Up
23 17 23 1 #Up
24 23 24 1
25 18 25 1 #Down
26 25 26 1
27 26 27 1
28 26 28 2
29 26 29 1
30 29 30 1
31 7 30 1 #Up
32 14 31 1
33 31 32 1
34 1 32 1 #Up
35 4 33 1 #Up
36 19 34 1 #Down
37 9 35 1 #Down
38 3 36 1 #Down
39 6 37 1
40 37 38 1
41 37 39 1
42 37 40 2
BRACKET 1 24.2900 -16.3100 24.2900 -14.7000
1 27.5100 -19.6000 27.5100 -21.2100
1 n
ORIGINAL 1 7 8 9 10 11 12 13 14 15 16 30 31 35
REPEAT 1
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