ATOM 39
1 C1y C 27.1328 -19.6516
2 C5x C 28.2914 -18.9805
3 N1x N 29.4500 -19.6444
4 C1y C 30.6156 -18.9734
5 C1b C 31.7744 -19.6375
6 C1c C 32.9329 -18.9662
7 C8x C 26.6254 -14.7522
8 C8y C 26.6254 -16.0945
9 C8x C 27.7973 -16.7656
10 C8x C 28.9552 -16.0945
11 C8y C 28.9552 -14.7522
12 C8x C 27.7973 -14.0811
13 C2x C 30.1177 -14.0819
14 O2x O 25.4638 -16.7663
15 C1y C 25.4646 -18.6878
16 C2x C 31.7878 -15.0436
17 N1x N 31.7851 -16.6894
18 C5x C 30.6126 -17.6240
19 O5x O 28.2884 -17.6312
20 O5x O 29.4478 -16.9458
21 N1b N 27.1339 -20.9939
22 C8y C 24.2986 -19.3703
23 C5a C 28.2963 -21.6642
24 O5a O 29.4578 -20.9921
25 C8x C 23.1312 -18.6890
26 C8x C 21.9652 -19.3713
27 C8x C 21.9669 -20.7191
28 C8x C 23.1344 -21.3917
29 C8x C 24.3074 -20.7164
30 C1a C 32.9248 -17.6234
31 C1c C 28.2975 -23.0135
32 N1c N 27.1361 -23.6856
33 C1c C 29.4600 -23.6837
34 C1b C 30.6285 -23.0116
35 C1a C 31.7910 -23.6819
36 C1a C 27.1371 -25.0278
37 C1a C 25.9665 -23.0153
38 C1a C 29.4612 -25.0259
39 C1a C 34.1044 -19.6333
BOND 41
1 8 9 2
2 18 20 2
3 9 10 1
4 1 21 1 #Up
5 10 11 2
6 15 22 1
7 11 12 1
8 21 23 1
9 12 7 2
10 23 24 2
11 1 2 1
12 11 13 1
13 3 4 1
14 8 14 1
15 22 25 2
16 25 26 1
17 26 27 2
18 27 28 1
19 28 29 2
20 29 22 1
21 14 15 1
22 4 5 1 #Down
23 30 6 1
24 13 16 2
25 23 31 1
26 15 1 1
27 31 32 1 #Down
28 2 3 1
29 31 33 1
30 16 17 1
31 33 34 1
32 5 6 1
33 34 35 1
34 4 18 1
35 32 36 1
36 18 17 1
37 32 37 1
38 7 8 1
39 33 38 1 #Up
40 2 19 2
41 6 39 1
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