ATOM 38
1 C1z C 28.5839 -16.1058
2 C1z C 27.4082 -16.7610
3 C1y C 29.8708 -16.5035
4 C1z C 28.5722 -14.7430
5 O2x O 28.8882 -17.4219
6 C1y C 26.2326 -16.0708
7 C1y C 27.4082 -18.1121
8 C1a C 28.0208 -15.3981
9 C1x C 30.6545 -15.4098
10 C1y C 29.8591 -14.3161
11 C1y C 27.4316 -14.0528
12 C1a C 28.6424 -13.3801
13 C1z C 25.0569 -16.7493
14 C5x C 26.2443 -14.7255
15 C1x C 26.2209 -18.7731
16 O1a O 28.5664 -18.7789
17 C8y C 30.2861 -12.9883
18 O1a O 27.4199 -12.6958
19 C1y C 25.0512 -18.1004
20 C1y C 23.8930 -16.0649
21 C1x C 25.0395 -15.6671
22 O5x O 25.0746 -14.0354
23 C8x C 29.4614 -11.8652
24 C8x C 31.6137 -12.5554
25 C1z C 23.8930 -18.7671
26 C1x C 22.7173 -16.7493
27 O1a O 23.8755 -14.7138
28 O2x O 23.4601 -17.3225
29 C8x C 30.2801 -10.7364
30 O2x O 31.6079 -11.1575
31 C1y C 22.7173 -18.1004
32 C1y C 23.4601 -19.9194
33 C1a C 24.5999 -20.2467
34 O7a O 21.5417 -18.7614
35 O1a O 22.1793 -20.6096
36 C7a C 20.3894 -18.0946
37 C1a C 19.2080 -18.7497
38 O6a O 20.3954 -16.7434
BOND 44
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
7 2 8 1 #Up
8 3 9 1
9 4 10 1
10 4 11 1
11 4 12 1 #Down
12 6 13 1
13 6 14 1
14 7 15 1
15 7 16 1 #Down
16 10 17 1 #Down
17 11 18 1 #Down
18 13 19 1
19 13 20 1
20 13 21 1 #Up
21 14 22 2
22 17 23 1
23 17 24 2
24 19 25 1
25 20 26 1
26 20 27 1 #Down
27 21 28 1
28 23 29 2
29 24 30 1
30 25 31 1
31 25 32 1 #Up
32 25 33 1 #Down
33 31 34 1 #Down
34 32 35 1
35 34 36 1
36 36 37 1
37 36 38 2
38 3 5 1 #Up
39 9 10 1
40 11 14 1
41 15 19 1
42 26 31 1
43 28 32 1
44 29 30 1
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