ATOM 55
1 C1y C 27.3774 -20.6161
2 C1y C 28.5936 -21.3118
3 C1y C 27.3774 -19.2129
4 O7a O 26.1671 -21.3177
5 C1y C 29.8039 -20.6102
6 O2a O 28.5936 -22.7151
7 O2x O 28.5877 -18.5112
8 C1b C 26.1613 -18.5170
9 C7a C 24.9570 -20.6161
10 C1y C 29.8039 -19.2129
11 O1a O 31.0200 -21.3118
12 C1y C 27.3774 -23.4108
13 O2a O 26.1613 -17.1137
14 C2b C 23.7467 -21.3177
15 O6a O 24.9570 -19.2186
16 O2a O 31.0142 -18.5170
17 C1y C 27.3833 -24.8140
18 O2x O 26.1671 -22.7151
19 C1y C 24.9453 -16.4123
20 C2b C 22.5421 -20.6161
21 C1b C 32.2186 -19.2186
22 C1y C 26.1671 -25.5157
23 O1a O 28.5936 -25.5157
24 C1y C 24.9510 -23.4167
25 O2x O 24.9336 -15.0148
26 C1y C 23.7350 -17.1197
27 C8y C 21.3318 -21.3177
28 C1b C 33.4289 -18.5229
29 C1y C 24.9510 -24.8200
30 O1a O 26.1730 -26.9189
31 C1a C 23.7407 -22.7208
32 C1y C 23.7233 -14.3191
33 C1y C 22.5187 -16.4240
34 O1a O 23.7407 -18.5170
35 C8x C 20.1157 -20.6161
36 C8x C 21.3377 -22.7151
37 C8y C 34.6334 -19.2246
38 O1a O 23.7407 -25.5216
39 C1y C 22.5130 -15.0265
40 C1b C 23.7116 -12.9216
41 O1a O 21.3143 -17.1314
42 C8y C 18.9054 -21.3177
43 C8x C 20.1215 -23.4225
44 C8x C 35.8495 -18.5229
45 C8x C 34.6334 -20.6219
46 O1a O 21.2967 -14.3308
47 O1a O 24.9219 -12.2142
48 C8y C 18.9054 -22.7208
49 O1a O 17.6892 -20.6219
50 C8y C 37.0598 -19.2246
51 C8x C 35.8495 -21.3235
52 O1a O 17.6951 -23.4225
53 C8y C 37.0598 -20.6219
54 O1a O 38.2701 -18.5229
55 O1a O 38.2701 -21.3235
BOND 59
1 1 2 1
2 1 3 1
3 1 4 1 #Down
4 2 5 1
5 2 6 1 #Up
6 3 7 1
7 3 8 1 #Up
8 4 9 1
9 5 10 1
10 5 11 1 #Down
11 12 6 1 #Up
12 8 13 1
13 9 14 1
14 9 15 2
15 10 16 1 #Up
16 12 17 1
17 12 18 1
18 19 13 1 #Up
19 14 20 2
20 16 21 1
21 17 22 1
22 17 23 1 #Down
23 18 24 1
24 19 25 1
25 19 26 1
26 20 27 1
27 21 28 1
28 22 29 1
29 22 30 1 #Down
30 24 31 1 #Down
31 25 32 1
32 26 33 1
33 26 34 1 #Down
34 27 35 1
35 27 36 2
36 28 37 1
37 29 38 1 #Up
38 32 39 1
39 32 40 1 #Up
40 33 41 1 #Up
41 35 42 2
42 36 43 1
43 37 44 2
44 37 45 1
45 39 46 1 #Down
46 40 47 1
47 42 48 1
48 42 49 1
49 44 50 1
50 45 51 2
51 48 52 1
52 50 53 2
53 50 54 1
54 53 55 1
55 7 10 1
56 24 29 1
57 33 39 1
58 43 48 2
59 51 53 1
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