ATOM 47
1 N5y N 11.6200 -10.6400 #+
2 C1y C 10.3600 -11.0600
3 O2x O 9.1700 -10.2200
4 C1y C 9.9400 -12.3200
5 C1y C 8.1200 -10.9900
6 C1y C 8.5400 -12.3200
7 O1a O 10.5700 -13.4400
8 C1b C 6.7900 -10.5700
9 O1a O 8.0500 -13.6500
10 O2b O 5.7400 -11.4800
11 P1b P 4.2700 -11.4800
12 O1c O 4.2700 -12.8800
13 O1c O 2.8700 -11.4800
14 O1c O 4.2700 -10.0800
15 C8x C 12.7400 -11.6200
16 C8y C 14.0700 -11.1300
17 C8x C 14.3500 -9.8000
18 C8y C 13.3000 -8.8200
19 C8x C 11.9000 -9.2400
20 C6a C 13.5800 -7.4200
21 O6a O 14.9100 -7.0000
22 O6a O 12.5300 -6.5100
23 C7a C 15.1200 -12.1100
24 O6a O 14.7700 -13.4400
25 O7a O 16.3324 -11.4100
26 N4y N 25.4100 -10.5700
27 C8y C 26.4600 -11.2700
28 C1y C 24.0800 -10.9900
29 C8x C 25.9000 -9.1700
30 C8y C 27.7200 -10.3600
31 N5x N 26.6000 -12.7400
32 O2x O 22.9600 -10.0800
33 C1y C 23.6600 -12.2500
34 N5x N 27.3000 -9.1700
35 C8y C 28.9800 -10.9200
36 C8x C 27.9300 -13.3000
37 C1y C 21.8400 -10.9200
38 C1y C 22.2600 -12.2500
39 O1a O 24.3600 -13.3700
40 N5x N 29.1200 -12.3900
41 N1a N 30.0300 -10.0800
42 C1b C 20.5100 -10.5000
43 O1a O 21.8400 -13.5100
44 O2b O 19.4600 -11.4100
45 P1b P 18.0600 -11.4100
46 O1c O 18.0600 -12.8100
47 O1c O 18.0600 -10.0100
BOND 51
1 2 1 1 #Up
2 2 3 1
3 2 4 1
4 3 5 1
5 4 6 1
6 4 7 1 #Down
7 5 8 1 #Up
8 6 9 1 #Down
9 8 10 1
10 10 11 1
11 11 12 1
12 11 13 1
13 11 14 2
14 5 6 1
15 1 15 2
16 15 16 1
17 16 17 2
18 17 18 1
19 18 19 2
20 1 19 1
21 18 20 1
22 20 21 2
23 20 22 1
24 16 23 1
25 23 24 2
26 23 25 1
27 26 27 1
28 28 26 1 #Up
29 26 29 1
30 27 30 2
31 27 31 1
32 28 32 1
33 28 33 1
34 29 34 2
35 30 35 1
36 31 36 2
37 32 37 1
38 33 38 1
39 33 39 1 #Down
40 35 40 2
41 35 41 1
42 37 42 1 #Up
43 38 43 1 #Down
44 42 44 1
45 44 45 1
46 45 46 1
47 45 47 2
48 30 34 1
49 36 40 1
50 37 38 1
51 25 45 1
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