ATOM 92
1 C1y C 48.0900 -12.8800
2 O2x O 49.2800 -13.5100
3 C1y C 50.4700 -12.8800
4 C1y C 50.4700 -11.4800
5 C1y C 49.2800 -10.7800
6 C1y C 48.0900 -11.4800
7 C1b C 51.7300 -13.5800
8 O7a O 52.9200 -12.8800
9 O1a O 51.7300 -10.7100
10 O1a O 46.8300 -10.7800
11 O1a O 49.2100 -9.3800
12 C7a C 54.1800 -13.5800
13 O6a O 54.1800 -14.9800
14 C1b C 55.4400 -12.8800
15 C1b C 56.6300 -13.5100
16 C1b C 57.8200 -12.8100
17 C1b C 59.0100 -13.5100
18 C1c C 60.2000 -12.8100
19 C1a C 61.3900 -13.5100
20 C1a C 60.2000 -11.4100
21 C2y C 20.2300 -16.3100
22 C1z C 18.9700 -15.6100
23 C2y C 20.2300 -17.7100
24 C2b C 21.4200 -15.6100
25 C1x C 17.7800 -16.3100
26 C1a C 19.6700 -14.3500
27 C1a C 18.2700 -14.3500
28 C1x C 18.9700 -18.4100
29 C1a C 21.4200 -18.4100
30 C2b C 22.6100 -16.3100
31 C1y C 17.7800 -17.7100
32 C2c C 23.8700 -15.6100
33 C2b C 25.0600 -16.3100
34 C1a C 23.8700 -14.2100
35 C2b C 26.2500 -15.6100
36 C2b C 27.5100 -16.3100
37 C2c C 28.7000 -15.6100
38 C2b C 29.8900 -16.3100
39 C1a C 28.7000 -14.2100
40 C2b C 31.1500 -15.6100
41 C2b C 32.3400 -16.3100
42 C2b C 33.5300 -15.6100
43 C2c C 34.7200 -16.3100
44 C2b C 35.9800 -15.6100
45 C1a C 34.7200 -17.7100
46 C2b C 37.1700 -16.3100
47 C2b C 38.3600 -15.6100
48 C2c C 39.6200 -16.3100
49 C2b C 40.8100 -15.6800
50 C1a C 39.6200 -17.7100
51 C2b C 42.0700 -16.3800
52 C2y C 43.3300 -15.6800
53 C1z C 44.5200 -16.3800
54 C2y C 43.3300 -14.2800
55 C1x C 45.7100 -15.6800
56 C1a C 44.1700 -17.7100
57 C1a C 45.2200 -17.5700
58 C1x C 44.5200 -13.5800
59 C1a C 42.0700 -13.5800
60 C1y C 45.7100 -14.2800
61 O2a O 16.5200 -18.4100
62 C1y C 15.2600 -19.0400
63 O2x O 14.0700 -18.4100
64 C1y C 12.8800 -19.0400
65 C1y C 12.8800 -20.4400
66 C1y C 14.0700 -21.1400
67 C1y C 15.2600 -20.4400
68 C1b C 11.6200 -18.3400
69 O7a O 10.4300 -19.0400
70 O1a O 11.6200 -21.2100
71 O1a O 16.5200 -21.1400
72 O1a O 14.1400 -22.5400
73 C7a C 9.1700 -18.3400
74 O6a O 9.1700 -16.9400
75 C1b C 7.9800 -19.0400
76 C1b C 6.7900 -18.4100
77 C1b C 5.6000 -19.1100
78 C1b C 4.4100 -18.4100
79 C1c C 3.2200 -19.1100
80 C1a C 2.0300 -18.4100
81 C1a C 3.2200 -20.5100
82 O2a O 46.9700 -13.5800
83 C1b C 5.6000 -19.1100
84 C1b C 5.6000 -19.1100
85 C1b C 5.6000 -19.1100
86 C1b C 5.6000 -19.1100
87 C1b C 5.6000 -19.1100
88 C1b C 57.8200 -12.8100
89 C1b C 57.8200 -12.8100
90 C1b C 57.8200 -12.8100
91 C1b C 57.8200 -12.8100
92 C1b C 57.8200 -12.8100
BOND 95
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 7 8 1
8 3 7 1 #Up
9 4 9 1 #Down
10 6 10 1 #Down
11 5 11 1 #Up
12 8 12 1
13 12 13 2
14 12 14 1
15 14 15 1
16 17 18 1
17 18 19 1
18 18 20 1
19 21 22 1
20 21 23 2
21 21 24 1
22 22 25 1
23 22 26 1
24 22 27 1
25 23 28 1
26 23 29 1
27 24 30 2
28 25 31 1
29 30 32 1
30 32 33 2
31 32 34 1
32 33 35 1
33 35 36 2
34 36 37 1
35 37 38 2
36 37 39 1
37 38 40 1
38 40 41 2
39 41 42 1
40 42 43 2
41 43 44 1
42 43 45 1
43 44 46 2
44 46 47 1
45 47 48 2
46 48 49 1
47 48 50 1
48 49 51 2
49 51 52 1
50 52 53 1
51 52 54 2
52 53 55 1
53 53 56 1
54 53 57 1
55 54 58 1
56 54 59 1
57 55 60 1
58 58 60 1
59 31 28 1
60 31 61 1 #Up
61 62 63 1
62 63 64 1
63 64 65 1
64 65 66 1
65 66 67 1
66 62 67 1
67 62 61 1 #Up
68 68 69 1
69 64 68 1 #Up
70 65 70 1 #Down
71 67 71 1 #Down
72 66 72 1 #Up
73 69 73 1
74 73 74 2
75 73 75 1
76 75 76 1
77 78 79 1
78 79 80 1
79 79 81 1
80 60 82 1 #Up
81 1 82 1 #Up
82 76 77 1
83 77 83 1
84 83 84 1
85 84 85 1
86 85 86 1
87 86 87 1
88 87 78 1
89 15 16 1
90 16 88 1
91 88 89 1
92 89 90 1
93 90 91 1
94 91 92 1
95 92 17 1
BRACKET 1 4.9700 -19.8800 4.9700 -17.6400
1 6.0200 -17.6400 6.0200 -19.8800
1 6
ORIGINAL 1 77
REPEAT 1 83 84 85 86 87
2 57.3300 -14.4900 57.3300 -12.2500
2 58.4500 -12.2500 58.4500 -14.4900
2 6
ORIGINAL 2 16
REPEAT 2 88 89 90 91 92
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