ATOM 31
1 C8x C 20.1890 -15.6905
2 C8x C 20.1890 -17.0935
3 C8x C 21.4008 -17.7983
4 C8y C 22.6124 -17.0935
5 C8x C 22.6124 -15.6905
6 C8x C 21.4008 -14.9926
7 C1b C 23.8289 -17.7973
8 C1c C 23.8196 -19.1942
9 N1a N 22.5990 -19.8840
10 C5a C 25.0309 -19.9002
11 N1c N 26.2376 -19.2013
12 C1c C 27.4502 -19.8992
13 C5a C 28.6628 -19.2013
14 N1b N 29.8752 -19.8992
15 C8y C 31.0808 -19.2013
16 C1a C 26.2357 -17.7983
17 O5a O 25.0288 -21.3032
18 C1b C 27.4502 -21.3022
19 O5a O 28.6628 -17.7983
20 C1b C 28.6662 -22.0071
21 C8x C 32.2951 -19.8964
22 C8x C 32.2917 -17.0963
23 C8x C 31.0791 -17.8012
24 C8y C 33.5060 -17.7983
25 C8y C 33.5058 -19.1939
26 C8x C 34.7152 -19.8881
27 C8x C 35.9248 -19.1940
28 C8x C 35.9250 -17.7985
29 C8x C 34.7154 -17.0972
30 C1b C 28.6662 -23.4100
31 N1a N 29.8820 -24.1080
BOND 33
1 11 16 1
2 8 7 1 #Up
3 10 17 2
4 2 3 1
5 12 18 1 #Down
6 8 9 1
7 13 19 2
8 3 4 2
9 18 20 1
10 8 10 1
11 4 5 1
12 10 11 1
13 5 6 2
14 11 12 1
15 15 21 2
16 21 25 1
17 24 22 1
18 22 23 2
19 23 15 1
20 6 1 1
21 12 13 1
22 13 14 1
23 4 7 1
24 14 15 1
25 24 25 2
26 25 26 1
27 26 27 2
28 27 28 1
29 28 29 2
30 29 24 1
31 20 30 1
32 1 2 2
33 30 31 1
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