ATOM 27
1 C8y C 24.4470 -17.4200
2 S4a S 25.6616 -16.7077
3 C8x C 24.4527 -18.8216
4 C8x C 23.2322 -16.7192
5 O1d O 26.8704 -17.4084 #-
6 O1d O 24.6572 -15.7149
7 O1d O 26.6485 -15.7149
8 C8x C 23.2381 -19.5224
9 C8x C 22.0178 -17.4259
10 C8y C 22.0234 -18.8275
11 N1a N 20.7971 -19.5165
12 Z Zn 31.1500 -16.0300 #2+
13 O0 O 32.1300 -18.4800
14 C8y C 24.4470 -17.4200
15 S4a S 25.6616 -16.7077
16 O1d O 26.8704 -17.4084 #-
17 O1d O 24.6572 -15.7149
18 O1d O 26.6485 -15.7149
19 C8x C 24.4527 -18.8216
20 C8x C 23.2381 -19.5224
21 C8y C 22.0234 -18.8275
22 N1a N 20.7971 -19.5165
23 C8x C 22.0178 -17.4259
24 C8x C 23.2322 -16.7192
25 O0 O 32.1300 -18.4800
26 O0 O 32.1300 -18.4800
27 O0 O 32.1300 -18.4800
BOND 22
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 1
5 2 6 2
6 2 7 2
7 3 8 2
8 4 9 1
9 8 10 1
10 10 11 1
11 9 10 2
12 14 15 1
13 14 19 1
14 14 24 2
15 15 16 1
16 15 17 2
17 15 18 2
18 19 20 2
19 24 23 1
20 20 21 1
21 21 22 1
22 23 21 2
BRACKET 1 18.3400 -20.3700 18.3400 -14.2800
1 28.2100 -14.2800 28.2100 -20.3700
1 2
ORIGINAL 1 1 2 5 6 7 3 8 10 11 9 4
REPEAT 1 14 15 16 17 18 19 20 21 22 23 24
2 30.1700 -19.4600 30.1700 -17.3600
2 32.8300 -17.3600 32.8300 -19.4600
2 4
ORIGINAL 2 13
REPEAT 2 25 26 27
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