ATOM 76
1 C2c C 24.8500 -9.4500
2 N1a N 26.0400 -8.7500
3 N1b N 23.6600 -8.7500
4 N2a N 24.8500 -10.8500
5 C1b C 22.4700 -9.4500
6 C1b C 21.2800 -8.7500
7 C1b C 20.0900 -9.4500
8 C1c C 18.9000 -8.7500
9 C5a C 17.7100 -9.4500
10 N1a N 18.9000 -7.3500
11 N1b N 16.5200 -8.7500
12 O5a O 17.7100 -10.8500
13 C1c C 15.3300 -9.4500
14 C1b C 14.1400 -8.7500
15 C8y C 12.9500 -9.4500
16 C8x C 11.7600 -8.7500
17 C8x C 10.5000 -9.4500
18 C8x C 10.5000 -10.8500
19 C8x C 11.6900 -11.5500
20 C8x C 12.9500 -10.8500
21 C5a C 15.3300 -10.8500
22 N1b N 16.5900 -11.4800
23 O5a O 14.1400 -11.6200
24 C1c C 16.5900 -12.8800
25 C1c C 15.4000 -13.5800
26 C1a C 14.2100 -12.8800
27 C1a C 15.4000 -14.9800
28 C5a C 17.7800 -13.5800
29 O5a O 18.9700 -12.8800
30 N1y N 17.7800 -14.9800
31 C1x C 16.6600 -15.8200
32 C1x C 17.0800 -17.1500
33 C1x C 18.4800 -17.1500
34 C1y C 18.9700 -15.8200
35 C5a C 20.1600 -15.1200
36 N1b N 21.3500 -15.8200
37 O5a O 20.1600 -13.7200
38 C1c C 22.5400 -15.1200
39 C1b C 23.7300 -15.8200
40 C5a C 22.5400 -13.2300
41 O5a O 21.2800 -12.6000
42 C6a C 24.9200 -15.1200
43 O6a O 26.1100 -15.8200
44 O6a O 24.9200 -13.7200
45 N1b N 23.7300 -12.4600
46 C1b C 24.9200 -13.1600
47 C5a C 26.1100 -12.4600
48 N1b N 27.3000 -13.1600
49 O5a O 26.1100 -11.0600
50 C1c C 28.5181 -12.4699
51 C1b C 29.6995 -13.1650
52 C5a C 28.4598 -11.0606
53 C5a C 29.6995 -14.5650
54 O5a O 28.4747 -15.2723
55 N1a N 30.8952 -15.2553
56 O5a O 27.2431 -10.4234
57 N1b N 29.6639 -10.2971
58 C1c C 30.9139 -10.9514
59 C5a C 32.1293 -10.1814
60 C1b C 30.9710 -12.3197
61 C1b C 32.1871 -12.9561
62 C1b C 33.3814 -12.1989
63 N1b N 34.6207 -12.8474
64 C2c C 35.8085 -12.0940
65 N1a N 37.0803 -12.7593
66 N2a N 35.8213 -10.7128
67 O5a O 33.3570 -10.8241
68 N1b N 32.1403 -8.7513
69 C1c C 33.3508 -8.0647
70 C1c C 34.5285 -8.7568
71 C6a C 33.2919 -6.6506
72 O6a O 34.6012 -5.9478
73 O6a O 32.1758 -5.9531
74 C1b C 35.7350 -8.0723
75 C1a C 36.9577 -8.7912
76 C1a C 34.5178 -10.1500
BOND 77
1 1 2 1
2 1 3 1
3 1 4 2
4 3 5 1
5 5 6 1
6 6 7 1
7 7 8 1
8 8 9 1
9 8 10 1 #Up
10 9 11 1
11 9 12 2
12 13 11 1 #Down
13 13 14 1
14 14 15 1
15 15 16 2
16 16 17 1
17 17 18 2
18 18 19 1
19 19 20 2
20 15 20 1
21 13 21 1
22 21 22 1
23 21 23 2
24 24 22 1 #Down
25 24 25 1
26 25 26 1
27 25 27 1
28 24 28 1
29 28 29 2
30 28 30 1
31 30 31 1
32 31 32 1
33 32 33 1
34 33 34 1
35 30 34 1
36 35 36 1
37 34 35 1 #Down
38 35 37 2
39 38 36 1 #Down
40 38 39 1
41 38 40 1
42 40 41 2
43 39 42 1
44 42 43 1
45 42 44 2
46 40 45 1
47 45 46 1
48 46 47 1
49 47 48 1
50 47 49 2
51 50 48 1 #Down
52 50 51 1
53 50 52 1
54 51 53 1
55 53 54 2
56 53 55 1
57 52 56 2
58 52 57 1
59 58 57 1 #Down
60 58 59 1
61 58 60 1
62 60 61 1
63 61 62 1
64 62 63 1
65 63 64 1
66 64 65 1
67 64 66 2
68 59 67 2
69 59 68 1
70 69 68 1 #Down
71 69 70 1
72 69 71 1
73 71 72 2
74 71 73 1
75 70 74 1
76 74 75 1
77 70 76 1 #Down
| 
