%chk=\\icnas1.cc.ic.ac.uk\aja4117\Desktop\Inorganic comp lab\nh3bh3 opt.chk
# opt b3lyp/6-31g(d,p) geom=connectivity integral=grid=ultrafine

nh3bh3 opt

0 1
 H                  1.58631013    2.48455946    0.00000000
 H                  1.58608813    0.91728646   -0.90492200
 H                  1.58602913    0.91724146    0.90486300
 H                  3.87717413    0.39494946    0.00006000
 H                  3.87669613    1.96217046   -0.90497800
 H                  3.87671413    1.96225246    0.90492100
 N                  1.98142413    1.43962846    0.00000000
 B                  3.48167413    1.43962846    0.00000000

 1 7 1.0
 2 7 1.0
 3 7 1.0
 4 8 1.0
 5 8 1.0
 6 8 1.0
 7 8 1.0
 8