ATOM 24
1 C1c C 26.4098 -19.8765
2 C5a C 27.6348 -20.5325
3 N1b N 25.2314 -20.6080
4 C1b C 26.4098 -18.4892
5 N1b N 28.8131 -19.8011
6 O5a O 27.6987 -22.1284
7 C5a C 24.0067 -19.9519
8 S2a S 27.5884 -17.7578
9 C1b C 30.0380 -20.4570
10 C1b C 22.8224 -20.6834
11 O5a O 24.0066 -18.5647
12 C6a C 31.2164 -19.7200
13 C1b C 21.6034 -20.0275
14 O6a O 32.4414 -20.3758
15 O6a O 31.2222 -18.3324
16 C1c C 20.4191 -20.7649
17 C6a C 19.1943 -20.1088
18 N1a N 20.4656 -22.1522
19 O6a O 18.0506 -20.8983
20 O6a O 19.2175 -18.7156
21 C5a C 27.5444 -16.3805
22 C1b C 26.2835 -15.7049
23 O5a O 28.7090 -15.6572
24 X Cl 25.0815 -16.4511
BOND 23
1 1 2 1
2 1 3 1
3 1 4 1 #Up
4 2 5 1
5 2 6 2
6 3 7 1
7 4 8 1
8 5 9 1
9 7 10 1
10 7 11 2
11 9 12 1
12 10 13 1
13 12 14 1
14 12 15 2
15 13 16 1
16 16 17 1
17 16 18 1 #Down
18 17 19 1
19 17 20 2
20 8 21 1
21 21 22 1
22 21 23 2
23 22 24 1
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