ATOM 45
1 C1y C 25.1300 -16.5200
2 C1y C 24.7100 -15.2600
3 C1y C 26.4600 -16.5200
4 O2b O 24.2200 -18.2000
5 O2x O 25.7600 -14.5600
6 C1b C 24.0800 -14.0000
7 C1y C 26.8100 -15.3300
8 O1a O 27.2300 -17.5700
9 P1b P 24.2200 -19.5300
10 O2b O 22.7500 -14.0000
11 R R 28.0700 -14.9100
12 O2b O 26.8100 -19.5300
13 O1c O 24.2200 -20.7900
14 O1c O 22.8900 -19.5300
15 P1b P 20.6500 -14.0000
16 C1b C 28.2100 -19.5300
17 O2b O 20.6500 -12.6700
18 O1c O 20.6500 -15.2600
19 O1c O 19.3200 -14.0000
20 C1y C 29.1200 -20.8600
21 C1y C 20.6500 -11.4100
22 C1y C 29.5400 -22.0500
23 O2x O 30.1700 -20.0900
24 C1y C 20.2300 -10.1500
25 C1y C 21.9800 -11.4100
26 C1y C 30.8700 -22.0500
27 O7a O 28.4900 -23.6600
28 C1y C 31.2200 -20.8600
29 O2x O 21.2800 -9.3800
30 C1y C 22.3300 -10.1500
31 O1a O 22.7500 -12.4600
32 O1a O 31.6400 -23.1000
33 R R 32.4800 -20.4400
34 R R 23.5900 -9.8000
35 C7a C 27.3000 -22.9600
36 C1c C 26.0400 -23.6600
37 C1b C 24.8500 -22.9600
38 C1b C 23.6600 -23.6600
39 C1b C 22.4000 -22.9600
40 C1b C 21.2100 -23.6600
41 O6a O 27.3000 -21.5600
42 N1a N 26.0400 -25.0600
43 N1a N 20.0200 -22.9600
44 C1b C 18.9000 -9.7300
45 O1a O 17.8500 -10.6400
BOND 47
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 22 27 1 #Down
27 23 28 1
28 24 29 1
29 25 30 1
30 25 31 1 #Down
31 26 32 1 #Down
32 28 33 1 #Up
33 30 34 1 #Up
34 5 7 1
35 26 28 1
36 29 30 1
37 27 35 1
38 35 36 1
39 36 37 1
40 37 38 1
41 38 39 1
42 39 40 1
43 35 41 2
44 36 42 1 #Up
45 40 43 1
46 24 44 1 #Up
47 44 45 1
BRACKET 1 21.9800 -14.6300 21.9800 -13.2300
1 25.4800 -18.9000 25.4800 -20.3700
1 n
ORIGINAL 1 1 2 3 4 5 6 7 8 9 10 11 13 14
REPEAT 1
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