ATOM 68
1 C1b C 39.2000 -28.4900
2 C5a C 40.4600 -27.7900
3 S2a S 41.6500 -28.4900
4 C1b C 42.8400 -27.7900
5 C1b C 44.1000 -28.4900
6 N1b N 45.2900 -27.7900
7 C5a C 46.4800 -28.4900
8 C1b C 47.7400 -27.7900
9 C1b C 48.9300 -28.4900
10 N1b N 50.1200 -27.7900
11 C5a C 51.3800 -28.4900
12 C1c C 52.5700 -27.7900
13 C1d C 53.7600 -28.4900
14 C1b C 54.9500 -27.7900
15 O2b O 56.2100 -28.4900
16 O5a O 40.4600 -26.3900
17 O5a O 46.4800 -29.8900
18 O5a O 51.3800 -29.8900
19 O1a O 52.5700 -26.3900
20 C1a C 53.7600 -27.0900
21 C1a C 53.7600 -29.8900
22 P1b P 57.6100 -28.4900
23 O1c O 59.0100 -28.4900
24 O1c O 57.6100 -29.8900
25 C1y C 51.1000 -23.5200
26 C1y C 52.5000 -23.5200
27 C1y C 52.9200 -22.1900
28 O2x O 51.8000 -21.3500
29 C1y C 50.6800 -22.1900
30 C1b C 54.2500 -21.7700
31 O1a O 50.2600 -24.6400
32 O2b O 53.3400 -24.6400
33 P1b P 54.7400 -24.6400
34 O1c O 54.7400 -23.2400
35 O1c O 56.1400 -24.6400
36 O1c O 54.7400 -26.0400
37 C8y C 46.5500 -20.3700
38 C8y C 46.5500 -21.7700
39 N4y N 49.0000 -21.7700
40 C8x C 49.0000 -20.3700
41 N5x N 47.7400 -19.6700
42 C8y C 45.3600 -19.6700
43 N5x N 44.1000 -20.3700
44 C8x C 44.1000 -21.7700
45 N5x N 45.3600 -22.4700
46 N1a N 45.3600 -18.2700
47 O2b O 56.2100 -22.1900
48 P1b P 57.6100 -22.1900
49 O1c O 57.6100 -20.7900
50 O1c O 59.0100 -22.1900
51 O2c O 57.6100 -25.4100
52 C1b C 38.0100 -27.7900
53 C1b C 36.8200 -28.4900
54 C1b C 35.5600 -27.7900
55 C1b C 34.3700 -28.4900
56 C1b C 33.1800 -27.7900
57 C1b C 31.9900 -28.4900
58 C2b C 30.8000 -27.8600
59 C2b C 29.4000 -27.8600
60 C1b C 28.2100 -28.4900
61 C2b C 27.0200 -27.8600
62 C2b C 25.6200 -27.8600
63 C1b C 24.4300 -28.4900
64 C1b C 23.2400 -27.8600
65 C1b C 22.1200 -28.4900
66 C1b C 20.9300 -27.8600
67 C1b C 19.7400 -28.4900
68 O1a O 18.5541 -27.7460
BOND 70
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 6 7 1
7 7 8 1
8 8 9 1
9 9 10 1
10 10 11 1
11 11 12 1
12 12 13 1
13 13 14 1
14 14 15 1
15 2 16 2
16 7 17 2
17 11 18 2
18 12 19 1 #Down
19 13 20 1
20 13 21 1
21 15 22 1
22 22 23 2
23 22 24 1
24 25 26 1
25 26 27 1
26 27 28 1
27 28 29 1
28 25 29 1
29 27 30 1 #Down
30 25 31 1 #Up
31 26 32 1 #Up
32 32 33 1
33 33 34 1
34 33 35 1
35 33 36 2
36 37 38 2
37 38 39 1
38 39 40 1
39 40 41 2
40 37 41 1
41 37 42 1
42 42 43 2
43 43 44 1
44 44 45 2
45 38 45 1
46 42 46 1
47 29 39 1 #Down
48 30 47 1
49 47 48 1
50 48 49 1
51 48 50 2
52 48 51 1
53 22 51 1
54 1 52 1
55 52 53 1
56 53 54 1
57 54 55 1
58 55 56 1
59 56 57 1
60 57 58 1
61 58 59 2
62 59 60 1
63 60 61 1
64 61 62 2
65 62 63 1
66 63 64 1
67 64 65 1
68 65 66 1
69 66 67 1
70 67 68 1
| 
