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PM7 MgHNO2 <Mg-N> <> <> <> <O-N-O> <> <Mg-H> GR=GPSS1993 Mg 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0 N 2.08000000 +1 0.0000000 +0 0.0000000 +0 1 0 0 XX 1.00000000 +0 90.0000000 +0 0.0000000 +0 1 2 0 O 1.29965476 +1 65.3937517 +1 0.0000000 +0 2 1 3 O 1.20304196 +1 118.0000000 +1 -108.8136398 +1 2 1 4 H 1.67000000 +1 158.1939745 +1 178.0910930 +1 1 2 3