ATOM 42
1 C1y C 25.0600 -18.4100
2 C1y C 24.6400 -17.1500
3 C1y C 26.3900 -18.4100
4 O2b O 24.1500 -20.0900
5 O2x O 25.6900 -16.4500
6 C1b C 24.0100 -15.8900
7 C1y C 26.7400 -17.2200
8 O1a O 27.1600 -19.4600
9 P1b P 24.1500 -21.4200
10 O2b O 22.6800 -15.8900
11 R R 28.0000 -16.8000
12 O2b O 26.7400 -21.4200
13 O1c O 24.1500 -22.6800
14 O1c O 22.8200 -21.4200
15 P1b P 20.5800 -15.8900
16 C1b C 28.1400 -21.4200
17 O2b O 20.5800 -14.5600
18 O1c O 20.5800 -17.1500
19 O1c O 19.2500 -15.8900
20 C1y C 29.0500 -22.7500
21 C1y C 20.5800 -13.3000
22 C1y C 29.4700 -23.9400
23 O2x O 30.1000 -21.9800
24 C1y C 20.1600 -12.0400
25 C1y C 21.9100 -13.3000
26 C1y C 30.8000 -23.9400
27 C1y C 31.1500 -22.7500
28 O2x O 21.2100 -11.2700
29 C1y C 22.2600 -12.0400
30 O1a O 22.6800 -14.3500
31 O1a O 31.5700 -24.9900
32 R R 32.4100 -22.3300
33 R R 23.5200 -11.6900
34 O7a O 28.2800 -24.6400
35 C7a C 27.0200 -23.9400
36 C1c C 25.8300 -24.6400
37 C1b C 24.6400 -23.9400
38 O1a O 23.3800 -24.6400
39 O6a O 27.0200 -22.5400
40 N1a N 25.8300 -26.0400
41 C1b C 18.9700 -11.3400
42 O1a O 17.7100 -12.0400
BOND 44
1 1 2 1
2 1 3 1
3 1 4 1 #Down
4 2 5 1
5 2 6 1 #Up
6 3 7 1
7 3 8 1 #Down
8 4 9 1
9 6 10 1
10 7 11 1 #Up
11 9 12 1
12 9 13 1
13 9 14 2
14 10 15 1
15 12 16 1
16 15 17 1
17 15 18 1
18 15 19 2
19 20 16 1 #Up
20 21 17 1 #Down
21 20 22 1
22 20 23 1
23 21 24 1
24 21 25 1
25 22 26 1
26 23 27 1
27 24 28 1
28 25 29 1
29 25 30 1 #Down
30 26 31 1 #Down
31 27 32 1 #Up
32 29 33 1 #Up
33 5 7 1
34 26 27 1
35 28 29 1
36 22 34 1 #Down
37 34 35 1
38 35 36 1
39 36 37 1
40 37 38 1
41 35 39 2
42 36 40 1 #Up
43 24 41 1 #Up
44 41 42 1
BRACKET 1 21.9800 -16.5200 21.9800 -15.1200
1 25.2000 -20.9300 25.2000 -22.4000
1 n
ORIGINAL 1 1 2 3 4 5 6 7 8 9 10 11 13 14
REPEAT 1
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