ATOM 40
1 C1y C 23.1000 -12.9500
2 C1y C 24.5000 -12.9500
3 C1y C 24.9200 -11.6200
4 O2x O 23.8000 -10.7800
5 C1y C 22.6800 -11.6200
6 C1b C 21.3500 -11.2000
7 R R 26.2500 -11.2000
8 O2b O 19.9500 -11.2000
9 P1b P 18.5500 -11.2000
10 O1c O 17.1500 -11.2000
11 O1c O 18.5500 -9.8000
12 O1c O 18.5500 -12.6000
13 O1a O 25.3400 -14.0700
14 O2b O 23.1000 -14.3500
15 C1y C 28.7000 -17.5000
16 C1y C 30.1000 -17.5000
17 C1y C 30.5200 -16.1700
18 O2x O 29.4000 -15.3300
19 C1y C 28.2800 -16.1700
20 C1b C 26.9500 -15.7500
21 R R 31.8500 -15.7500
22 O2b O 25.5500 -15.7500
23 P1b P 23.1000 -15.7500
24 O1c O 21.7000 -15.7500
25 O1c O 23.1000 -17.1500
26 O1a O 30.9400 -18.6200
27 O2b O 28.7000 -18.9000
28 C1y C 34.6500 -22.0500
29 C1y C 36.0500 -22.0500
30 C1y C 36.4700 -20.7200
31 O2x O 35.3500 -19.8800
32 C1y C 34.2300 -20.7200
33 C1b C 32.9000 -20.3000
34 R R 37.8000 -20.3000
35 O2b O 31.5000 -20.3000
36 P1b P 28.7000 -20.3000
37 O1c O 27.3000 -20.3000
38 O1c O 28.7000 -21.7000
39 O1a O 36.8900 -23.1700
40 O1a O 33.8224 -23.1792
BOND 42
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 1 5 1
6 5 6 1 #Up
7 3 7 1 #Up
8 6 8 1
9 8 9 1
10 9 10 1
11 9 11 1
12 9 12 2
13 2 13 1 #Down
14 1 14 1 #Down
15 15 16 1
16 16 17 1
17 17 18 1
18 18 19 1
19 15 19 1
20 19 20 1 #Up
21 17 21 1 #Up
22 20 22 1
23 22 23 1
24 23 24 2
25 23 14 1
26 23 25 1
27 16 26 1 #Down
28 15 27 1 #Down
29 28 29 1
30 29 30 1
31 30 31 1
32 31 32 1
33 28 32 1
34 32 33 1 #Up
35 30 34 1 #Up
36 33 35 1
37 35 36 1
38 36 37 2
39 36 27 1
40 36 38 1
41 29 39 1 #Down
42 28 40 1 #Down
BRACKET 1 24.7800 -16.7300 24.7800 -14.9800
1 29.8900 -19.3200 29.8900 -21.0700
1 n
ORIGINAL 1 15 16 17 18 19 20 21 22 26 27 36 37 38
REPEAT 1
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