ATOM 34
1 C1y C 21.0654 -17.3992
2 C1y C 21.0582 -18.8587
3 C1y C 22.3213 -19.5948
4 C1x C 23.5843 -18.8708
5 C1y C 23.5913 -17.4113
6 O2x O 22.3353 -16.6823
7 C1a C 24.8543 -16.6945
8 N1c N 22.3071 -21.0474
9 O1a O 19.7953 -19.5755
10 C1a C 21.0443 -21.7710
11 C1a C 23.5702 -21.7832
12 O2a O 19.8060 -16.6681
13 C1y C 18.6187 -15.9803
14 C1y C 18.5995 -14.6046
15 C1x C 17.4235 -13.9376
16 C1a C 19.7649 -13.9261
17 C1y C 17.4235 -12.5910
18 C5x C 16.2465 -11.9370
19 C1a C 18.5646 -11.9429
20 C2x C 15.0940 -12.5910
21 O5x O 16.2465 -10.5946
22 C2x C 15.0940 -13.9376
23 C1z C 13.7658 -14.6046
24 C1c C 12.7109 -16.6472
25 C1y C 13.8185 -15.9571
26 C1a C 12.4050 -14.0768
27 O7x O 15.0595 -16.6319
28 O6a O 16.2246 -14.6085
29 C1a C 12.7007 -17.9925
30 C1y C 17.4234 -16.6685
31 C7x C 16.2237 -15.9716
32 C1a C 17.4096 -18.0346
33 O1a O 13.7586 -13.1523
34 O1a O 11.3586 -16.2848
BOND 35
1 8 10 1
2 4 5 1
3 8 11 1
4 1 12 1 #Down
5 5 6 1
6 6 1 1
7 13 14 1
8 14 15 1
9 14 16 1 #Down
10 15 17 1
11 17 18 1
12 17 19 1 #Down
13 18 20 1
14 18 21 2
15 20 22 2
16 22 23 1
17 23 25 1
18 23 26 1 #Down
19 25 24 1 #Down
20 25 27 1
21 27 31 1
22 5 7 1 #Down
23 31 28 2
24 1 2 1
25 24 29 1
26 3 8 1 #Down
27 13 30 1
28 2 3 1
29 30 31 1
30 2 9 1 #Up
31 30 32 1 #Up
32 3 4 1
33 23 33 1 #Up
34 13 12 1 #Down
35 24 34 1 #Up
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