ATOM 43
1 C1z C 26.6387 -16.3877
2 C1y C 25.4283 -15.6860
3 C1y C 26.7028 -17.7676
4 C2y C 27.9602 -15.9725
5 C1a C 26.4753 -15.1360
6 C1z C 24.2236 -16.3760
7 C1b C 25.4166 -14.3002
8 C1y C 25.4223 -18.4519
9 O2x O 27.9485 -18.2004
10 C1y C 28.7612 -17.0836
11 C2y C 28.7670 -14.8557
12 C1y C 24.2236 -17.7676
13 C1y C 23.0366 -15.6802
14 C1a C 24.2119 -14.9843
15 C7a C 26.6094 -13.5985
16 O2x O 25.0423 -19.8142
17 C1x C 30.0768 -16.6625
18 C1y C 30.0768 -15.2826
19 C1a C 28.7553 -13.5807
20 C1z C 23.0309 -18.4519
21 C1x C 21.8262 -16.3760
22 O7a O 23.0192 -14.3002
23 O7a O 26.5977 -12.1834
24 O6a O 27.8315 -14.3002
25 C1x C 23.3875 -19.8142
26 C8y C 30.7785 -14.0547
27 C1y C 21.8262 -17.7676
28 C1a C 21.8205 -19.4159
29 C7a C 21.8205 -13.6043
30 C1a C 27.8081 -11.4643
31 C8x C 30.3399 -12.7156
32 C8x C 32.1818 -14.0547
33 O7a O 20.6217 -18.4519
34 C2c C 20.6217 -14.3002
35 O6a O 21.8205 -12.2185
36 C8x C 31.4802 -11.8852
37 O2x O 32.6087 -12.7156
38 C7a C 19.4230 -17.7559
39 C2b C 19.4230 -13.6043
40 C1a C 20.6158 -15.6802
41 C1a C 18.2243 -18.4402
42 O6a O 19.4230 -16.6502
43 C1a C 18.2243 -14.3002
BOND 48
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1 #Up
5 2 6 1
6 2 7 1 #Down
7 3 8 1
8 3 9 1
9 4 10 1
10 4 11 2
11 6 12 1
12 6 13 1
13 6 14 1 #Up
14 7 15 1
15 8 16 1
16 10 17 1
17 11 18 1
18 11 19 1
19 12 20 1
20 13 21 1
21 13 22 1 #Down
22 15 23 1
23 15 24 2
24 16 25 1
25 18 26 1 #Down
26 20 27 1
27 20 28 1 #Up
28 22 29 1
29 23 30 1
30 26 31 1
31 26 32 2
32 27 33 1 #Down
33 29 34 1
34 29 35 2
35 31 36 2
36 32 37 1
37 33 38 1
38 34 39 2
39 34 40 1
40 38 41 1
41 38 42 2
42 39 43 1
43 8 12 1
44 9 10 1
45 17 18 1
46 20 25 1
47 21 27 1
48 36 37 1
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