ATOM 27
1 C1z C 28.4789 -16.3352
2 C8y C 27.2683 -15.6276
3 C1y C 27.3384 -17.1657
4 C1x C 29.6250 -17.1657
5 N1y N 29.7069 -15.6393
6 C8y C 27.2741 -14.2183
7 C8x C 26.0695 -16.3352
8 C8y C 27.7829 -18.4990
9 O1a O 26.1221 -17.2255
10 C8y C 29.1864 -18.4932
11 C1x C 29.7127 -14.2300
12 C1a C 30.9175 -16.3411
13 C8x C 26.0695 -13.5223
14 C1x C 28.4964 -13.5282
15 C8y C 24.8472 -15.6276
16 C8y C 27.0753 -19.7155
17 C8x C 29.8882 -19.7095
18 C8y C 24.8472 -14.2183
19 O2a O 23.6250 -16.3236
20 C8y C 27.7946 -20.9376
21 O2x O 25.6952 -20.0196
22 C8x C 29.1864 -20.9318
23 O2a O 23.6307 -13.5223
24 C1a C 22.4027 -15.6219
25 O2x O 26.8472 -21.9902
26 C1x C 25.5548 -21.4229
27 C1a C 22.4144 -14.2124
BOND 31
1 1 2 1 #Down
2 1 3 1
3 1 4 1
4 1 5 1 #Up
5 2 6 2
6 2 7 1
7 3 8 1
8 3 9 1 #Down
9 4 10 1
10 5 11 1
11 5 12 1
12 6 13 1
13 6 14 1
14 7 15 2
15 8 16 1
16 10 17 1
17 13 18 2
18 15 19 1
19 16 20 2
20 16 21 1
21 17 22 2
22 18 23 1
23 19 24 1
24 20 25 1
25 21 26 1
26 23 27 1
27 8 10 2
28 11 14 1
29 15 18 1
30 20 22 1
31 25 26 1
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