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HEADER
COMPND IOF5(estim)
Gérard Dupuis
REMARK : créé à partir des longueurs de liaison estimées.
ATOM 1 I 0.000 0.000 0.000
ATOM 2 F -1,414 1,414 0,000
ATOM 3 F -1,414 -1,414 0,000
ATOM 4 F 1,414 1.414 0.000
ATOM 5 F 1,414 -1,414 0,000
ATOM 6 F 0,000 0,000 -2,000
ATOM 7 O 0,000 0,000 1,930
CONECT 1 2
CONECT 1 3
CONECT 1 4
CONECT 1 5
CONECT 1 6
CONECT 1 7 7
MASTER 0 0 0 0 0 0 0 0 3 0 0 0
END