%chk=\\icnas4.cc.ic.ac.uk\md5317\Desktop\2ndyearlab\MD_bh3_opt.chk
# opt b3lyp/3-21g geom=connectivity integral=grid=ultrafine

BH3 Optimisation

0 1
 B                  6.87247599    3.82352935   -0.08996564
 H                  8.41247599    3.82352935   -0.08996564
 H                  6.10747598    5.14854822   -0.08996564
 H                  6.09747598    2.48118998   -0.08996564

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