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CHARGE=-3 PM7 Rhodium(III) hexacyanide I=-4.11 IR=PW91D H=282.8 HR=PW91D Rh 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0 C 1.94859418 +1 0.0000000 +0 0.0000000 +0 1 0 0 C 1.94860924 +1 90.0026879 +1 0.0000000 +0 1 2 0 C 1.94859635 +1 89.9959489 +1 179.9118568 +1 1 2 3 C 1.94860095 +1 89.9989676 +1 179.9942879 +1 1 4 2 C 1.94857110 +1 89.9961933 +1 -90.0851747 +1 1 2 4 C 1.94863453 +1 90.0024650 +1 179.9512325 +1 1 2 6 N 1.17045015 +1 134.9988623 +1 179.9992556 +1 2 3 1 N 1.17044375 +1 134.9972371 +1 -179.9794700 +1 4 2 1 N 1.17045008 +1 179.9973838 +1 -177.2235702 +1 5 1 3 N 1.17038664 +1 134.9922344 +1 179.9921500 +1 6 2 1 N 1.17047470 +1 135.0022467 +1 179.9703925 +1 7 2 1 N 1.17047382 +1 135.0047553 +1 179.9832589 +1 3 2 1