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GRADIENTS SHIFT=80 PULAY PM7 Calcium monoamide <Ca-N> GR=CHIK1986 Ca 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0 N 2.13200000 +1 0.0000000 +0 0.0000000 +0 1 0 0 H 0.98865342 +1 125.4506046 +1 0.0000000 +0 2 1 0 H 0.98863846 +1 125.4391395 +1 177.0000000 +1 2 1 3