ATOM 29
1 C8y C 31.9948 -29.7600
2 C8x C 33.2149 -30.3714
3 C8y C 34.3255 -29.6667
4 C8y C 32.0121 -28.4476
5 C8x C 33.1219 -27.7534
6 C8y C 34.2790 -28.3577
7 C1y C 36.3853 -28.8363
8 C1z C 35.5072 -27.7850
9 N1y N 35.6580 -30.0038
10 C1x C 37.9878 -25.3140
11 C5x C 36.6285 -31.0827
12 C1x C 37.9246 -30.9494
13 C1y C 38.4540 -29.7507
14 O5x O 36.0622 -32.3423
15 C1x C 37.4290 -26.4431
16 C1y C 36.1341 -26.5922
17 C1y C 37.6882 -28.6855
18 C1y C 38.1959 -27.4971
19 C2y C 39.4547 -27.1557
20 C2x C 40.4986 -27.9125
21 O2x O 39.5722 -30.0665
22 C1x C 40.5503 -29.2054
23 N1y N 35.3675 -25.5494
24 O2a O 30.8203 -27.7590
25 C1a C 29.6367 -28.4424
26 O2a O 30.9613 -30.4501
27 C1a C 29.8129 -29.8442
28 C1x C 34.0327 -25.8992
29 C1x C 33.6805 -27.2235
BOND 35
1 15 16 1
2 16 8 1
3 7 8 1
4 8 6 1
5 17 18 1
6 3 9 1
7 18 19 1
8 9 7 1
9 19 20 2
10 3 6 2
11 5 4 2
12 20 22 1
13 21 22 1
14 13 21 1
15 4 1 1
16 16 23 1
17 10 19 1
18 23 10 1
19 9 11 1
20 4 24 1
21 11 12 1
22 24 25 1
23 12 13 1
24 1 26 1
25 5 6 1
26 26 27 1
27 13 17 1
28 11 14 2
29 1 2 2
30 2 3 1
31 23 28 1
32 7 17 1
33 28 29 1
34 8 29 1 #Up
35 18 15 1
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