ATOM 41
1 C1y C 26.5636 -19.6315
2 C5x C 27.7274 -18.9544
3 N1x N 28.8911 -19.6244
4 C1y C 30.0618 -18.9473
5 C1b C 31.2255 -19.6173
6 C8y C 32.3892 -18.9404
7 C8x C 26.0641 -14.7191
8 C8y C 26.0641 -16.0662
9 C8x C 27.2341 -16.7363
10 C8x C 28.3970 -16.0662
11 C8y C 28.3970 -14.7191
12 C8x C 27.2341 -14.0420
13 C2x C 29.5646 -14.0429
14 O2x O 24.8904 -16.7368
15 C1y C 24.8911 -18.6694
16 C2x C 31.2389 -15.0101
17 N1x N 31.2362 -16.9396
18 C5x C 30.0587 -17.6003
19 O5x O 27.7243 -17.6074
20 O5x O 28.8887 -16.9232
21 N1b N 26.5646 -20.9786
22 C8y C 23.7201 -19.3436
23 C5a C 27.7323 -21.6548
24 O5a O 28.8989 -20.9767
25 C8x C 22.5545 -18.6704
26 C8x C 21.3834 -19.3446
27 C8x C 21.3851 -20.7044
28 C8x C 22.5577 -21.3757
29 C8x C 23.7287 -20.7015
30 C8x C 33.5482 -19.6180
31 C8x C 34.7120 -18.9409
32 C8x C 34.7103 -17.5967
33 C8x C 33.5449 -16.9296
34 C8x C 32.3811 -17.5996
35 C1c C 27.7335 -23.0019
36 N1c N 26.5668 -23.6798
37 C1c C 28.9009 -23.6779
38 C1a C 26.5679 -25.0270
39 C1a C 25.3992 -23.0037
40 C1a C 28.9021 -25.0252
41 C1a C 30.0746 -23.0000
BOND 44
1 9 10 1
2 1 21 1 #Up
3 10 11 2
4 15 22 1
5 11 12 1
6 21 23 1
7 12 7 2
8 23 24 2
9 1 2 1
10 11 13 1
11 3 4 1
12 8 14 1
13 22 25 2
14 25 26 1
15 26 27 2
16 27 28 1
17 28 29 2
18 29 22 1
19 14 15 1
20 4 5 1 #Down
21 13 16 2
22 15 1 1
23 2 3 1
24 16 17 1
25 6 30 2
26 30 31 1
27 31 32 2
28 32 33 1
29 33 34 2
30 34 6 1
31 5 6 1
32 23 35 1
33 4 18 1
34 35 36 1 #Down
35 18 17 1
36 35 37 1
37 7 8 1
38 36 38 1
39 2 19 2
40 36 39 1
41 8 9 2
42 37 40 1
43 18 20 2
44 37 41 1
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