ATOM 86
1 C2b C 17.3600 -21.4200
2 C2b C 18.5724 -20.7200
3 C1c C 19.7849 -21.4200
4 C1b C 20.9973 -20.7200
5 C2b C 22.2097 -21.4200
6 C2b C 23.4222 -20.7200
7 C1c C 24.6346 -21.4200
8 C1b C 25.8470 -20.7200
9 C1c C 27.0595 -21.4200
10 C1b C 28.2719 -20.7200
11 C1c C 29.4844 -21.4200
12 C1b C 30.6968 -20.7200
13 C1c C 31.9092 -21.4200
14 C1b C 33.1217 -20.7200
15 C2b C 34.3341 -21.4200
16 C2b C 35.5465 -20.7200
17 C1c C 36.7590 -21.4200
18 C1b C 37.9714 -20.7200
19 C1c C 39.1838 -21.4200
20 C1b C 40.3963 -20.7200
21 C1c C 41.6087 -21.4200
22 C1b C 42.8211 -20.7200
23 C5a C 44.0336 -21.4200
24 C1c C 45.2460 -20.7200
25 C1c C 46.4585 -21.4200
26 O2a O 47.6709 -20.7200
27 C1b C 46.4585 -22.8200
28 C2b C 47.6870 -23.5294
29 C2c C 47.6870 -24.9294
30 C1b C 46.4576 -25.6200
31 C1b C 45.2451 -24.9200
32 C2b C 44.0327 -25.6200
33 C2b C 42.8203 -24.9200
34 C1c C 41.6078 -25.6200
35 C1c C 40.3954 -24.9200
36 C1c C 39.1830 -25.6200
37 C1c C 37.9705 -24.9200
38 C2b C 36.7581 -25.6200
39 C2b C 35.5456 -24.9200
40 C2b C 34.3332 -25.6200
41 C2b C 33.1208 -24.9200
42 C2b C 31.9083 -25.6200
43 C2b C 30.6959 -24.9200
44 C2b C 29.4835 -25.6200
45 C2b C 28.2710 -24.9200
46 C2b C 27.0586 -25.6200
47 C2b C 25.8462 -24.9200
48 C1b C 24.6337 -25.6200
49 C1b C 23.4213 -24.9200
50 C1a C 45.2460 -19.3202
51 O5a O 44.0336 -22.8200
52 O1a O 41.6087 -22.6797
53 O1a O 39.1838 -22.8199
54 O1a O 36.7590 -22.6800
55 O1a O 31.9092 -22.8200
56 O1a O 29.4844 -22.8199
57 O1a O 27.0595 -22.8197
58 O7a O 24.6346 -22.8200
59 C7a C 23.4262 -23.5177
60 O6a O 22.2339 -22.8263
61 O1a O 19.7849 -22.8198
62 C1b C 16.1476 -20.7200
63 C1c C 14.9521 -21.4104
64 C1b C 13.7647 -20.7249
65 O1a O 14.9520 -22.8197
66 C1b C 12.5735 -21.4129
67 C1b C 11.3840 -20.7262
68 N1a N 10.1939 -21.4135
69 C1a C 37.9705 -23.5203
70 O1a O 39.1830 -27.0199
71 C1a C 40.3954 -23.5200
72 O1a O 41.6078 -27.0197
73 C1b C 48.8785 -25.6267
74 C1b C 50.0838 -24.9401
75 C2b C 51.2582 -25.6272
76 C2a C 52.4639 -24.9403
77 C1y C 47.6709 -19.3200
78 C1y C 48.8827 -18.6204
79 C1y C 48.8827 -17.2204
80 C1y C 47.6702 -16.5204
81 C1y C 46.4585 -17.2200
82 O2x O 46.4585 -18.6200
83 C1a C 45.2623 -16.5292
84 O1a O 47.6702 -15.1200
85 O1a O 50.0781 -16.5300
86 O1a O 50.0778 -19.3106
BOND 87
1 1 2 2
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 2
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 15 16 2
16 16 17 1
17 17 18 1
18 18 19 1
19 19 20 1
20 20 21 1
21 21 22 1
22 22 23 1
23 23 24 1
24 24 25 1
25 25 26 1
26 25 27 1
27 27 28 1
28 28 29 2
29 29 30 1
30 30 31 1
31 31 32 1
32 32 33 2
33 33 34 1
34 34 35 1
35 35 36 1
36 36 37 1
37 37 38 1
38 38 39 2
39 39 40 1
40 40 41 2
41 41 42 1
42 42 43 2
43 43 44 1
44 44 45 2
45 45 46 1
46 46 47 2
47 47 48 1
48 48 49 1
49 24 50 1
50 23 51 2
51 21 52 1
52 19 53 1
53 17 54 1
54 13 55 1
55 11 56 1
56 9 57 1
57 7 58 1
58 58 59 1
59 59 49 1
60 59 60 2
61 3 61 1
62 1 62 1
63 62 63 1
64 63 64 1
65 63 65 1
66 64 66 1
67 66 67 1
68 67 68 1
69 37 69 1
70 36 70 1
71 35 71 1
72 34 72 1
73 29 73 1
74 73 74 1
75 74 75 1
76 75 76 2
77 77 26 1
78 77 78 1
79 78 79 1
80 79 80 1
81 80 81 1
82 81 82 1
83 77 82 1
84 81 83 1
85 80 84 1
86 79 85 1
87 78 86 1
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