ATOM 36
1 N4y N 23.5583 -15.5410
2 C8y C 24.6281 -16.2893
3 C1y C 22.2664 -15.9678
4 C8x C 24.0436 -14.1381
5 C8y C 25.8673 -15.3715
6 N5x N 24.6225 -17.7158
7 C1y C 21.8337 -17.2246
8 O2x O 21.1265 -15.1085
9 N5x N 25.4991 -14.1498
10 C8y C 27.1301 -15.9327
11 C8x C 26.0253 -18.3061
12 C1y C 20.4425 -17.2246
13 O1a O 22.4944 -18.3644
14 C1y C 20.0157 -15.9095
15 N5x N 27.1537 -17.4235
16 N1c N 28.2406 -15.1027
17 N1b N 19.6241 -18.3587
18 C1b C 18.6829 -15.4709
19 C1a C 29.5269 -15.6521
20 C1a C 28.2170 -13.7113
21 C5a C 20.3140 -19.5628
22 O1a O 17.6423 -16.4064
23 C1c C 19.6065 -20.7729
24 O5a O 21.7110 -19.4988
25 C1b C 20.3023 -21.9772
26 C8y C 21.6993 -21.9772
27 C8x C 22.3891 -23.1873
28 C8x C 22.4008 -20.7788
29 C8x C 23.7804 -23.1931
30 C8x C 23.7921 -20.7788
31 C8y C 24.4819 -21.9889
32 O2a O 25.8790 -21.9947
33 C1a C 26.5747 -20.7729
34 N1a N 18.2094 -20.7672
35 X Cl 31.4299 -19.5999
36 X Cl 31.4299 -19.5999
BOND 37
1 1 2 1
2 3 1 1 #Up
3 1 4 1
4 2 5 2
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 2
9 5 10 1
10 6 11 2
11 7 12 1
12 7 13 1 #Down
13 8 14 1
14 10 15 2
15 10 16 1
16 12 17 1
17 14 18 1 #Up
18 16 19 1
19 16 20 1
20 17 21 1
21 18 22 1
22 21 23 1
23 21 24 2
24 23 25 1
25 25 26 1
26 26 27 2
27 26 28 1
28 27 29 1
29 28 30 2
30 29 31 2
31 31 32 1
32 32 33 1
33 5 9 1
34 11 15 1
35 12 14 1
36 30 31 1
37 23 34 1 #Down
BRACKET 1 29.3300 -20.5100 29.3300 -18.5500
1 32.4100 -18.5500 32.4100 -20.5100
1 2
ORIGINAL 1 35
REPEAT 1 36
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