ATOM 95
1 N1b N 21.3500 -16.3800
2 C1c C 22.5400 -15.6800
3 C5a C 23.8000 -16.3800
4 N1b N 24.9900 -15.6800
5 C1c C 26.1800 -16.3800
6 C5a C 27.4400 -15.6800
7 N1b N 28.6300 -16.3800
8 C1c C 29.8200 -15.6800
9 C5a C 31.0800 -16.3800
10 N1b N 32.2700 -15.6800
11 C1c C 33.4600 -16.3800
12 C5a C 21.3500 -17.7800
13 C1c C 20.1600 -18.4800
14 O5a O 22.5400 -18.4800
15 N1b N 20.1600 -19.8800
16 C5a C 18.9700 -20.5800
17 O5a O 18.9700 -21.9800
18 C1b C 17.7800 -19.8800
19 C1c C 16.5900 -20.5800
20 C1b C 15.4000 -19.8800
21 O7a O 16.5900 -21.9800
22 C7a C 16.5900 -23.3800
23 O6a O 15.4000 -24.0800
24 C1c C 17.7800 -24.0800
25 N1b N 19.0400 -23.3800
26 C5a C 20.2300 -24.0800
27 C1c C 21.4200 -23.3800
28 N1b N 22.6800 -24.0800
29 C5a C 23.8700 -23.3800
30 C1c C 25.0600 -24.0800
31 N1b N 26.3200 -23.3800
32 C5a C 27.5100 -24.0800
33 C1c C 28.7000 -23.3800
34 N1b N 29.9600 -24.0800
35 C5a C 31.1500 -23.3800
36 C1b C 17.7800 -25.4800
37 C6a C 16.5900 -26.1800
38 O6a O 15.3300 -25.4800
39 O6a O 16.5900 -27.5800
40 O5a O 20.2300 -25.4800
41 C1c C 21.4200 -21.9800
42 C1b C 22.6100 -21.2800
43 C1a C 22.6100 -19.8800
44 O5a O 23.8700 -21.9800
45 C1c C 25.0600 -25.4800
46 C1b C 23.8700 -26.1800
47 C1a C 26.2500 -26.1800
48 C1a C 23.8700 -27.5800
49 O5a O 27.5100 -25.4800
50 C1b C 28.7000 -21.9800
51 O1a O 27.5100 -21.2800
52 O5a O 31.1500 -21.9800
53 C1b C 18.9700 -17.7800
54 C1c C 18.9700 -16.3800
55 C1a C 20.1600 -15.6800
56 C1a C 17.7800 -15.6800
57 C1b C 22.5400 -14.2800
58 O5a O 23.8000 -17.7800
59 C1c C 26.1800 -17.7800
60 C1a C 24.9900 -18.4800
61 O1a O 27.3700 -18.4800
62 O5a O 27.4400 -14.2800
63 C1b C 29.8200 -14.2800
64 C1c C 31.0100 -13.5800
65 C1a C 31.0100 -12.1800
66 C1a C 32.2000 -14.2800
67 O5a O 31.0800 -17.7800
68 C1b C 14.2100 -20.5800
69 C1b C 12.9500 -19.8800
70 C1b C 11.7600 -20.5800
71 C1b C 10.5700 -19.8800
72 C1b C 9.3100 -20.5800
73 C1a C 8.1200 -19.8800
74 C1c C 32.6900 -23.7300
75 N1b N 33.8800 -22.4000
76 C5a C 33.4600 -17.7800
77 O5a O 32.2700 -18.4800
78 N1b N 34.6500 -18.4800
79 C1c C 34.6500 -19.8800
80 C5a C 33.4600 -20.5800
81 O5a O 32.2700 -19.8800
82 C1b C 33.0400 -25.0600
83 C1c C 34.3700 -25.4100
84 C1a C 35.3500 -24.4300
85 C1a C 34.7200 -26.7400
86 C1b C 35.8653 -20.5751
87 O1a O 37.0537 -19.8823
88 C1b C 34.6753 -15.6849
89 C1c C 35.8637 -16.3777
90 C1a C 37.0601 -15.6935
91 C1a C 35.8580 -17.7799
92 C6a C 23.7553 -13.5849
93 O6a O 23.7553 -12.1849
94 O6a O 24.9451 -14.2753
95 C1a C 21.0577 -20.6277
BOND 95
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 1 12 1
12 12 13 1
13 12 14 2
14 13 15 1
15 15 16 1
16 16 17 2
17 16 18 1
18 18 19 1
19 19 20 1
20 19 21 1
21 21 22 1
22 22 23 2
23 22 24 1
24 24 25 1
25 25 26 1
26 26 27 1
27 27 28 1
28 28 29 1
29 29 30 1
30 30 31 1
31 31 32 1
32 32 33 1
33 33 34 1
34 34 35 1
35 24 36 1 #Up
36 36 37 1
37 37 38 1
38 37 39 2
39 26 40 2
40 27 41 1
41 41 42 1
42 42 43 1
43 29 44 2
44 30 45 1
45 45 46 1
46 45 47 1 #Up
47 46 48 1
48 32 49 2
49 33 50 1 #Up
50 50 51 1
51 35 52 2
52 13 53 1 #Down
53 53 54 1
54 54 55 1
55 54 56 1
56 2 57 1 #Down
57 3 58 2
58 5 59 1
59 59 60 1
60 59 61 1 #Up
61 6 62 2
62 8 63 1 #Down
63 63 64 1
64 64 65 1
65 64 66 1
66 9 67 2
67 20 68 1
68 68 69 1
69 69 70 1
70 70 71 1
71 71 72 1
72 72 73 1
73 35 74 1
74 74 75 1
75 11 76 1
76 76 77 2
77 76 78 1
78 78 79 1
79 79 80 1
80 80 81 2
81 80 75 1
82 74 82 1 #Up
83 82 83 1
84 83 84 1
85 83 85 1
86 79 86 1 #Down
87 86 87 1
88 11 88 1 #Down
89 88 89 1
90 89 90 1
91 89 91 1
92 57 92 1
93 92 93 1
94 92 94 2
95 41 95 1 #Up
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