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CHARGE=-2 UHF PM7 Cu(I)2I4(2-) (BIYMIF) <Cu-Cu> <Cu-I(br)><I-Cu-Cu> <Cu-I(t)><I-Cu-Cu> GR=CCDC Cu 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0 Cu 2.72295800 +1 0.0000000 +0 0.0000000 +0 1 0 0 I 2.56542000 +1 58.6107380 +1 0.0000000 +0 2 1 0 I 2.51544000 +1 125.7980000 +1 -179.9703775 +1 2 3 1 I 2.65091554 +1 60.1081900 +1 -179.9953441 +1 1 2 3 I 2.64986813 +1 124.4415167 +1 179.9633429 +1 1 5 2