ATOM 30
1 C8x C 19.6700 -15.6100
2 C8y C 19.6700 -17.0100
3 N4x N 20.8824 -17.7100
4 C8y C 22.0949 -17.0100
5 C8y C 22.0949 -15.6100
6 N4y N 20.8824 -14.9100
7 N5x N 23.1353 -14.6732
8 C8y C 22.5659 -13.3942
9 C8y C 21.1735 -13.5406
10 O5x O 20.2066 -12.4665
11 C1c C 23.2698 -12.1753
12 C1b C 24.6400 -12.1756
13 C1a C 25.3383 -10.9666
14 C1a C 22.5650 -10.9535
15 C8y C 18.4576 -17.7100
16 C8y C 17.1974 -17.1488
17 C8y C 16.2743 -18.1739
18 N4x N 16.9639 -19.3686
19 C8x C 18.3132 -19.0819
20 C8x C 16.7649 -15.8173
21 C8x C 15.3955 -15.5261
22 C8x C 14.4724 -16.5511
23 C8x C 14.9049 -17.8827
24 C1b C 23.3324 -17.7100
25 C1b C 24.5449 -17.0100
26 C1b C 25.7573 -17.7100
27 N1b N 26.9697 -17.0100
28 C2c C 28.1822 -17.7100
29 N1a N 29.3946 -17.0100
30 N2a N 28.1822 -19.1097
BOND 33
1 1 2 2
2 2 3 1
3 3 4 1
4 4 5 2
5 5 6 1
6 1 6 1
7 5 7 1
8 7 8 2
9 8 9 1
10 6 9 1
11 9 10 2
12 8 11 1
13 11 12 1
14 12 13 1
15 11 14 1 #Up
16 2 15 1
17 15 16 1
18 16 17 1
19 17 18 1
20 18 19 1
21 15 19 2
22 16 20 2
23 20 21 1
24 21 22 2
25 22 23 1
26 17 23 2
27 4 24 1
28 24 25 1
29 25 26 1
30 26 27 1
31 27 28 1
32 28 29 1
33 28 30 2
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