ATOM 39
1 C7a C 24.1156 -18.8269
2 O7a O 25.3470 -19.5380
3 O6a O 24.1156 -17.4117
4 C1a C 22.8876 -19.5387
5 O2a O 31.4143 -18.6899
6 C1y C 30.2042 -19.5784
7 O2x O 29.0004 -18.8528
8 C1y C 30.1963 -20.9798
9 C1y C 27.7769 -19.5645
10 C1y C 28.9848 -21.6553
11 O7a O 31.4170 -21.6724
12 C1y C 27.7693 -20.9659
13 C1b C 26.5685 -18.8536
14 O7a O 28.9821 -23.0599
15 O7a O 26.5530 -21.6565
16 C7a C 32.6484 -22.3811
17 O6a O 32.6504 -23.7926
18 C1a C 33.8654 -21.6623
19 C7a C 28.9862 -24.4662
20 O6a O 27.7587 -25.1749
21 C1a C 30.1958 -25.1815
22 C7a C 25.3270 -22.3585
23 O6a O 24.1142 -21.6442
24 C1a C 25.3171 -23.7617
25 C1y C 31.4023 -17.1722
26 C1y C 30.2294 -16.4704
27 C1y C 30.2294 -15.0899
28 C2y C 31.4023 -14.4116
29 C1y C 28.9201 -14.6703
30 O2x O 32.5997 -16.4704
31 C2x C 32.5997 -15.0899
32 C1a C 31.3966 -13.0425
33 O7a O 28.4770 -13.3465
34 C1y C 28.9118 -16.9000
35 C1y C 28.1107 -15.7744
36 O2x O 27.5429 -17.0352
37 C7a C 27.2561 -12.6609
38 O6a O 27.2430 -11.2599
39 C1a C 26.0555 -13.3694
BOND 42
1 22 23 2
2 10 14 1 #Up
3 22 24 1
4 12 15 1 #Down
5 25 5 1 #Up
6 10 12 1
7 13 2 1
8 6 5 1 #Up
9 6 7 1
10 6 8 1
11 7 9 1
12 1 4 1
13 1 2 1
14 16 11 1
15 16 17 2
16 1 3 2
17 26 27 1
18 26 25 1
19 26 34 1
20 27 28 1
21 27 29 1
22 25 30 1
23 28 31 2
24 28 32 1
25 29 35 1
26 30 31 1
27 16 18 1
28 29 33 1 #Up
29 8 10 1
30 19 14 1
31 19 20 2
32 8 11 1 #Down
33 19 21 1
34 34 35 1
35 34 36 1 #Up
36 35 36 1 #Up
37 9 12 1
38 33 37 1
39 9 13 1 #Up
40 37 38 2
41 22 15 1
42 37 39 1
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