ATOM 75
1 C1y C 10.2900 -21.2800
2 C1y C 9.3100 -21.8400
3 C1z C 10.2900 -20.0900
4 C1x C 12.5300 -21.2800
5 C1y C 8.1900 -21.2800
6 C1y C 9.3100 -23.1700
7 C1y C 11.4100 -19.3200
8 C1x C 9.2400 -19.3900
9 C1a C 10.2900 -18.6900
10 C1x C 12.5300 -20.0200
11 C1z C 7.0700 -21.9100
12 C1x C 8.1900 -20.0200
13 C1x C 8.1900 -23.8000
14 O1a O 10.4300 -23.8000
15 C1c C 11.4100 -18.0600
16 C2y C 7.0700 -23.1700
17 C1x C 5.9500 -21.2800
18 C1a C 7.0700 -20.5800
19 C1b C 12.6000 -17.3600
20 C2x C 6.0200 -23.8700
21 C1x C 4.9000 -21.9100
22 C1b C 13.7200 -17.9900
23 C5x C 4.9000 -23.1700
24 O5x O 3.7800 -23.8700
25 C1a C 10.3600 -17.2900
26 C5a C 14.9800 -17.2900
27 S2a S 16.1700 -17.9900
28 C1b C 17.3600 -17.2900
29 C1b C 18.6200 -17.9900
30 N1b N 19.8100 -17.2900
31 C5a C 21.0000 -17.9900
32 C1b C 22.2600 -17.2900
33 C1b C 23.4500 -17.9900
34 N1b N 24.6400 -17.2900
35 C5a C 25.9000 -17.9900
36 C1c C 27.0900 -17.2900
37 C1d C 28.2800 -17.9900
38 C1b C 29.4700 -17.2900
39 O2b O 30.7300 -17.9900
40 O5a O 14.9800 -15.8900
41 O5a O 21.0000 -19.3900
42 O5a O 25.9000 -19.3900
43 O1a O 27.0900 -15.8900
44 C1a C 28.2800 -16.5900
45 C1a C 28.2800 -19.3900
46 P1b P 32.1300 -17.9900
47 O1c O 33.5300 -17.9900
48 O1c O 32.1300 -19.3900
49 C1y C 25.6200 -13.0200
50 C1y C 27.0200 -13.0200
51 C1y C 27.4400 -11.6900
52 O2x O 26.3200 -10.8500
53 C1y C 25.2000 -11.6900
54 C1b C 28.7700 -11.2700
55 O1a O 24.7800 -14.1400
56 O2b O 27.8600 -14.1400
57 P1b P 29.2600 -14.1400
58 O1c O 29.2600 -12.7400
59 O1c O 30.6600 -14.1400
60 O1c O 29.2600 -15.5400
61 C8y C 21.0700 -9.8700
62 C8y C 21.0700 -11.2700
63 N4y N 23.5200 -11.2700
64 C8x C 23.5200 -9.8700
65 N5x N 22.2600 -9.1700
66 C8y C 19.8800 -9.1700
67 N5x N 18.6200 -9.8700
68 C8x C 18.6200 -11.2700
69 N5x N 19.8800 -11.9700
70 N1a N 19.8800 -7.7700
71 O2b O 30.7300 -11.6900
72 P1b P 32.1300 -11.6900
73 O1c O 32.1300 -10.2900
74 O1c O 33.5300 -11.6900
75 O2c O 32.1300 -14.9100
BOND 81
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 3 8 1
8 3 9 1 #Up
9 4 10 1
10 5 11 1
11 5 12 1
12 6 13 1
13 6 14 1 #Up
14 7 15 1
15 11 16 1
16 11 17 1
17 11 18 1 #Up
18 15 19 1
19 16 20 2
20 17 21 1
21 19 22 1
22 20 23 1
23 23 24 2 #Down
24 7 10 1
25 8 12 1
26 13 16 1
27 21 23 1
28 15 25 1 #Down
29 22 26 1
30 26 27 1
31 27 28 1
32 28 29 1
33 29 30 1
34 30 31 1
35 31 32 1
36 32 33 1
37 33 34 1
38 34 35 1
39 35 36 1
40 36 37 1
41 37 38 1
42 38 39 1
43 26 40 2
44 31 41 2
45 35 42 2
46 36 43 1 #Down
47 37 44 1
48 37 45 1
49 39 46 1
50 46 47 2
51 46 48 1
52 49 50 1
53 50 51 1
54 51 52 1
55 52 53 1
56 49 53 1
57 51 54 1 #Down
58 49 55 1 #Up
59 50 56 1 #Up
60 56 57 1
61 57 58 1
62 57 59 1
63 57 60 2
64 61 62 2
65 62 63 1
66 63 64 1
67 64 65 2
68 61 65 1
69 61 66 1
70 66 67 2
71 67 68 1
72 68 69 2
73 62 69 1
74 66 70 1
75 53 63 1 #Down
76 54 71 1
77 71 72 1
78 72 73 1
79 72 74 2
80 72 75 1
81 46 75 1
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