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sp-hybrid on the N atom in a bonding combination with s-functions on the H atoms.

sp-hybrid on the N atom in an anti-bonding combination with s-functions on the H atoms.

HOMO LUMO N 2S 0.374167 0.425253 N 2Px -0.500557 0.274706 N 2Py -0.500557 0.274706 N 2Pz -0.500557 0.274706 H 1S -0.190023 -0.444511 H 1S -0.190023 -0.444511 H 1S -0.190023 -0.444511