ATOM 9
1 X Cl 21.0000 -17.5000
2 C2b C 22.2124 -16.8000
3 C2a C 23.4249 -17.5000
4 C2a C 29.4700 -17.3600
5 C2b C 30.6824 -16.6600
6 O7a O 31.8949 -17.3600
7 C7a C 33.1073 -16.6600
8 C1a C 34.3197 -17.3600
9 O6a O 33.1073 -15.2600
BOND 7
1 1 2 1
2 2 3 2
3 4 5 2
4 5 6 1
5 6 7 1
6 7 8 1
7 7 9 2
BRACKET 1 20.1600 -18.6900 20.1600 -15.9600
1 25.6900 -15.9600 25.6900 -18.6900
1 n
ORIGINAL 1 1 2 3
REPEAT 1
2 27.7200 -18.8300 27.7200 -14.5600
2 36.0500 -14.5600 36.0500 -18.8300
2 n
ORIGINAL 2 4 5 6 7 8 9
REPEAT 2
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