ATOM 27
1 C1y C 32.8090 -18.1848
2 C1x C 33.2362 -19.6301
3 C1x C 34.6221 -19.5794
4 N1y N 35.0683 -18.2672
5 C1y C 33.9585 -17.4371
6 C8y C 29.1605 -17.4989
7 C8y C 29.1605 -16.0935
8 C8x C 27.9592 -18.1926
9 C5a C 30.3792 -18.1926
10 C8x C 27.9592 -15.3880
11 O2a O 30.3792 -15.3880
12 C8y C 26.7406 -17.4989
13 N1b N 31.5918 -17.4929
14 O5a O 30.3792 -19.5978
15 C8y C 26.7406 -16.0935
16 X Cl 25.5279 -18.1926
17 N1b N 25.5279 -15.3880
18 C1a C 24.3175 -16.0816
19 C1b C 36.2465 -17.5959
20 C8y C 37.4614 -18.2821
21 C8x C 37.4715 -19.6740
22 C8x C 38.6859 -20.3602
23 C8x C 39.8875 -19.6513
24 C8x C 39.8742 -18.2563
25 C8x C 38.6596 -17.5701
26 C1a C 30.3806 -13.9649
27 C1a C 34.0052 -16.0224
BOND 29
1 8 12 1
2 9 13 1
3 9 14 2
4 10 15 1
5 12 16 1
6 1 13 1 #Up
7 15 17 1
8 12 15 2
9 6 7 1
10 6 8 2
11 17 18 1
12 6 9 1
13 2 3 1
14 4 19 1
15 3 4 1
16 19 20 1
17 4 5 1
18 5 1 1
19 1 2 1
20 7 10 2
21 20 21 2
22 21 22 1
23 22 23 2
24 23 24 1
25 24 25 2
26 25 20 1
27 7 11 1
28 11 26 1
29 5 27 1 #Up
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