ATOM 27
1 C1y C 35.8838 -19.4214
2 O2x O 36.5712 -18.1841
3 C1y C 34.5090 -19.4214
4 C1y C 35.8838 -17.0155
5 C1y C 33.8217 -18.1841
6 O1a O 33.8217 -20.5899
7 C1y C 34.5090 -17.0155
8 C1b C 36.5712 -15.8470
9 O1a O 32.4469 -18.2528
10 O1a O 33.8217 -15.8470
11 O1a O 35.8838 -14.6785
12 C8y C 39.5957 -27.8074
13 C8y C 39.5957 -29.1822
14 C8y C 40.7642 -27.1200
15 N5x N 38.2896 -27.3262
16 N4x N 38.2896 -29.5946
17 N5x N 40.7642 -29.8695
18 N5x N 42.0015 -27.8074
19 N1b N 40.7642 -25.7453
20 C8x C 37.4648 -28.4948
21 C8x C 42.0015 -29.1822
22 C1b C 39.5957 -25.0579
23 C1b C 39.5957 -23.6831
24 C1c C 38.4271 -22.9957
25 C1a C 37.1898 -23.6831
26 C1b C 38.4271 -21.6210
27 O2a O 37.2586 -20.9336
BOND 29
1 1 2 1
2 1 3 1
3 2 4 1
4 3 5 1
5 3 6 1 #Down
6 4 7 1
7 4 8 1 #Up
8 5 9 1 #Up
9 7 10 1 #Down
10 8 11 1
11 5 7 1
12 12 13 2
13 12 14 1
14 12 15 1
15 13 16 1
16 13 17 1
17 14 18 2
18 14 19 1
19 15 20 2
20 17 21 2
21 19 22 1
22 22 23 1
23 23 24 1
24 24 25 1
25 24 26 1
26 16 20 1
27 18 21 1
28 26 27 1
29 1 27 1 #Up
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