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GEO-OK PM7 Magnesium di-hydroxide H=-113.8 HR=PW91D Mg 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0 O 1.71612051 +1 0.0000000 +0 0.0000000 +0 1 0 0 XX 1.00000000 +0 90.0000000 +0 0.0000000 +0 1 2 0 H 0.86438471 +1 179.5987791 +1 0.0000000 +0 2 1 3 O 1.71612051 +1 179.6643787 +1 0.0577618 +1 1 2 3 H 0.86438444 +1 179.6257457 +1 0.1197607 +1 5 1 3