%chk=\\ic.ac.uk\homes\ny210\Desktop\3rdyearlab\BH3_OPTBB.chk
# opt b3lyp/6-31g(d,p) geom=connectivity nosymm

BH3 optimisation better basis

0 1
 B                  0.00000000    0.00000000    0.00000000
 H                  0.00000000    1.19349000    0.00000000
 H                  1.03359200   -0.59674500    0.00000000
 H                 -1.03359200   -0.59674500    0.00000000

 1 2 1.0 3 1.0 4 1.0
 2
 3
 4

