ATOM 21
1 C8x C 26.7415 -21.8880
2 C8x C 26.7415 -19.2079
3 C8y C 27.9043 -19.8780
4 C8y C 27.8984 -21.2179
5 C1x C 29.0553 -21.8931
6 N1y N 30.2252 -21.2282
7 C8y C 25.5786 -21.2179
8 C8y C 25.5829 -19.8751
9 O2x O 24.3026 -19.4528
10 C1x C 23.5123 -20.5402
11 O2x O 24.2958 -21.6322
12 C1z C 29.0671 -19.2131
13 C1y C 30.2252 -19.8912
14 C1x C 31.3879 -19.2328
15 C1y C 31.3294 -17.8895
16 C2x C 30.2411 -17.2116
17 C2x C 29.0786 -17.8768
18 O1a O 32.5649 -17.2295
19 C1y C 30.2262 -18.5308
20 C1x C 31.3759 -20.5479
21 O1a O 32.3193 -18.5168
BOND 25
1 8 9 1
2 9 10 1
3 10 11 1
4 11 7 1
5 3 4 2
6 4 5 1
7 5 6 1
8 6 13 1
9 12 3 1
10 2 8 2
11 12 13 1
12 13 14 1
13 14 15 1
14 15 16 1
15 16 17 2
16 17 12 1
17 7 1 2
18 15 18 1 #Up
19 1 4 1
20 12 19 1 #Down
21 3 2 1
22 6 20 1 #Down
23 19 20 1
24 7 8 1
25 19 21 1
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