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SYMMETRY PM7 Antimony triiodide H=-2.4 HR=PW91D I 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0 Sb 2.72938693 +1 0.0000000 +0 0.0000000 +0 1 0 0 I 2.72938693 +0 99.7570752 +1 0.0000000 +0 2 1 0 I 2.72938693 +0 99.7570752 +0 -101.6971571 +1 2 1 3 2 1 3 4 3 2 4