ATOM 39
1 C1z C 27.5041 -17.2956
2 C1z C 28.4784 -18.2642
3 C5x C 27.4984 -19.2267
4 C2y C 26.1332 -17.2956
5 C5a C 28.6884 -16.6014
6 C1y C 28.4784 -19.6351
7 C1b C 29.6627 -17.5698
8 C1a C 29.6627 -18.9526
9 C1z C 26.1332 -20.6094
10 O5x O 26.3374 -18.7308
11 C2y C 25.1589 -18.2642
12 O1a O 26.1273 -15.9188
13 C1c C 28.6884 -15.2305
14 O5a O 30.0711 -16.6014
15 C1x C 27.5041 -20.6094
16 C1b C 29.6627 -20.3235
17 C1b C 30.8528 -18.2525
18 C5x C 25.1589 -19.6351
19 C1b C 26.1273 -21.9803
20 C1b C 23.9629 -17.5758
21 C1a C 29.8727 -14.5305
22 C1a C 27.4924 -14.5362
23 C2b C 29.6568 -21.7003
24 C2b C 32.0371 -17.5641
25 O5x O 23.9629 -20.3177
26 C2b C 25.1472 -22.9546
27 C2b C 23.9513 -16.1989
28 C2c C 30.8470 -22.3828
29 C2c C 33.2330 -18.2466
30 C2c C 25.1356 -24.3314
31 C2c C 22.7553 -15.5105
32 C1a C 30.8411 -23.7596
33 C1a C 32.0313 -21.6944
34 C1a C 34.4173 -17.5524
35 C1a C 33.2213 -19.6176
36 C1a C 23.9455 -25.0139
37 C1a C 26.3315 -25.0198
38 C1a C 22.7496 -14.1337
39 C1a C 21.5653 -16.1930
BOND 40
1 1 2 1
2 1 3 1 #Up
3 1 4 1
4 1 5 1
5 2 6 1
6 2 7 1
7 2 8 1 #Up
8 9 3 1 #Up
9 3 10 2
10 4 11 2
11 4 12 1
12 5 13 1
13 5 14 2
14 6 15 1
15 6 16 1 #Up
16 7 17 1
17 9 18 1
18 9 19 1
19 11 20 1
20 13 21 1
21 13 22 1
22 16 23 1
23 17 24 1
24 18 25 2
25 19 26 1
26 20 27 1
27 23 28 2
28 24 29 2
29 26 30 2
30 27 31 2
31 28 32 1
32 28 33 1
33 29 34 1
34 29 35 1
35 30 36 1
36 30 37 1
37 31 38 1
38 31 39 1
39 9 15 1
40 11 18 1
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