ATOM 13
1 Z As 14.9100 -15.6800
2 O0 O 14.9100 -14.2800
3 O1a O 16.7300 -15.6800 #-
4 O1a O 13.5100 -15.6800 #-
5 O1a O 14.9100 -17.1500 #-
6 Z Ca 20.5800 -15.7500 #2+
7 Z Ca 20.6413 -13.6150 #2+
8 Z Ca 20.7156 -17.8009 #2+
9 Z As 14.9100 -15.6800
10 O0 O 14.9100 -14.2800
11 O1a O 16.7300 -15.6800 #-
12 O1a O 13.5100 -15.6800 #-
13 O1a O 14.9100 -17.1500 #-
BOND 8
1 1 2 2
2 1 3 1
3 1 4 1
4 1 5 1
5 9 10 2
6 9 11 1
7 9 12 1
8 9 13 1
BRACKET 1 12.4600 -17.7800 12.4600 -13.7200
1 17.7100 -13.7200 17.7100 -17.7800
1 2
ORIGINAL 1 1 2 3 4 5
REPEAT 1 9 10 11 12 13
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