%chk=H:\3rdyearlab\BH3_OPT_631g_dp.chk
# opt b3lyp/6-31g(d,p) geom=connectivity nosymm

BH3 optimisation

0 1
 B                  0.00000000    0.00000000    0.00000000
 H                  0.00000000    1.50000000    0.00000000
 H                 -1.29903800   -0.75000000    0.00000000
 H                  1.29903800   -0.75000000    0.00000000

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