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UHF SHIFT=80 SYMMETRY CHARGE=-1 PULAY ITRY=200 PM7 Palladium tetracyanide GR=SJL71 <Pd-C> C 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0 Pd 2.00100000 +1 0.0000000 +0 0.0000000 +0 1 0 0 C 2.00100000 +0 111.6157118 +1 0.0000000 +0 2 1 0 C 2.00100000 +0 73.7111186 +1 -107.4989513 +1 2 1 3 C 2.00100000 +0 75.8344097 +1 173.4737678 +1 2 1 3 N 1.16317641 +1 180.0000000 +0 0.0000000 +0 1 2 3 N 1.15788500 +0 180.0000000 +0 0.0000000 +0 3 2 1 N 1.15788500 +0 180.0000000 +0 0.0000000 +0 4 2 1 N 1.15788500 +0 180.0000000 +0 0.0000000 +0 5 2 1 2 1 3 4 5