ATOM 69
1 C1y C 14.4900 -22.9600
2 C1y C 14.5600 -21.5600
3 C1x C 13.1600 -23.3800
4 C1b C 15.6800 -24.5000
5 C5x C 13.2300 -21.1400
6 C1b C 15.6800 -20.0200
7 C1x C 12.3900 -22.2600
8 C1b C 16.8700 -23.8000
9 O5x O 12.8100 -19.8100
10 C2b C 16.7300 -20.7200
11 C1b C 18.0600 -24.5000
12 C2b C 18.0600 -20.7200
13 C1b C 19.3200 -23.8000
14 C1b C 19.1100 -20.0200
15 C1b C 20.5100 -24.5000
16 C1a C 20.3000 -20.7200
17 C1c C 21.7000 -23.8000
18 C1b C 22.8900 -24.5700
19 O1a O 21.7000 -22.3300
20 C5a C 24.1500 -23.8700
21 S2a S 25.3400 -24.5700
22 C1b C 26.5300 -23.8700
23 C1b C 27.7900 -24.5700
24 N1b N 28.9800 -23.8700
25 C5a C 30.1700 -24.5700
26 C1b C 31.4300 -23.8700
27 C1b C 32.6200 -24.5700
28 N1b N 33.8100 -23.8700
29 C5a C 35.0700 -24.5700
30 C1c C 36.2600 -23.8700
31 C1d C 37.4500 -24.5700
32 C1b C 38.6400 -23.8700
33 O2b O 39.9000 -24.5700
34 O5a O 24.1500 -22.4700
35 O5a O 30.1700 -25.9700
36 O5a O 35.0700 -25.9700
37 O1a O 36.2600 -22.4700
38 C1a C 37.4500 -23.1700
39 C1a C 37.4500 -25.9700
40 P1b P 41.3000 -24.5700
41 O1c O 42.7000 -24.5700
42 O1c O 41.3000 -25.9700
43 C1y C 34.7900 -19.6000
44 C1y C 36.1900 -19.6000
45 C1y C 36.6100 -18.2700
46 O2x O 35.4900 -17.4300
47 C1y C 34.3700 -18.2700
48 C1b C 37.9400 -17.8500
49 O1a O 33.9500 -20.7200
50 O2b O 37.0300 -20.7200
51 P1b P 38.4300 -20.7200
52 O1c O 38.4300 -19.3200
53 O1c O 39.8300 -20.7200
54 O1c O 38.4300 -22.1200
55 C8y C 30.2400 -16.4500
56 C8y C 30.2400 -17.8500
57 N4y N 32.6900 -17.8500
58 C8x C 32.6900 -16.4500
59 N5x N 31.4300 -15.7500
60 C8y C 29.0500 -15.7500
61 N5x N 27.7900 -16.4500
62 C8x C 27.7900 -17.8500
63 N5x N 29.0500 -18.5500
64 N1a N 29.0500 -14.3500
65 O2b O 39.9000 -18.2700
66 P1b P 41.3000 -18.2700
67 O1c O 41.3000 -16.8700
68 O1c O 42.7000 -18.2700
69 O2c O 41.3000 -21.4900
BOND 72
1 1 2 1
2 1 3 1
3 1 4 1 #Up
4 2 5 1
5 2 6 1 #Up
6 3 7 1
7 4 8 1
8 5 9 2
9 6 10 1
10 8 11 1
11 10 12 2
12 11 13 1
13 12 14 1
14 13 15 1
15 14 16 1
16 15 17 1
17 17 18 1
18 5 7 1
19 17 19 1
20 18 20 1
21 20 21 1
22 21 22 1
23 22 23 1
24 23 24 1
25 24 25 1
26 25 26 1
27 26 27 1
28 27 28 1
29 28 29 1
30 29 30 1
31 30 31 1
32 31 32 1
33 32 33 1
34 20 34 2
35 25 35 2
36 29 36 2
37 30 37 1 #Down
38 31 38 1
39 31 39 1
40 33 40 1
41 40 41 2
42 40 42 1
43 43 44 1
44 44 45 1
45 45 46 1
46 46 47 1
47 43 47 1
48 45 48 1 #Down
49 43 49 1 #Up
50 44 50 1 #Up
51 50 51 1
52 51 52 1
53 51 53 1
54 51 54 2
55 55 56 2
56 56 57 1
57 57 58 1
58 58 59 2
59 55 59 1
60 55 60 1
61 60 61 2
62 61 62 1
63 62 63 2
64 56 63 1
65 60 64 1
66 47 57 1 #Down
67 48 65 1
68 65 66 1
69 66 67 1
70 66 68 2
71 66 69 1
72 40 69 1
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