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SHIFT=50 PM7 Phosphorus tribromide H=-34.9 HR=JANAF86 I=10.0 IR=LLNBS82 Br 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0 P 2.23797618 +1 0.0000000 +0 0.0000000 +0 1 0 0 Br 2.23974348 +1 102.7609111 +1 0.0000000 +0 2 1 0 Br 2.23974516 +1 102.7497930 +1 -106.2051880 +1 2 1 3