%chk=H:\Chemistry Year 1\1styearlab\MSS3117_ch4_optf_pop.chk
# opt freq b3lyp/6-31g(d,p) geom=connectivity integral=grid=ultrafine
pop=(full,nbo)

ch4 optimisation

0 1
 C                  0.00000000   -0.00000000    0.00000000
 H                  0.00000000    0.00000000    1.06999990
 H                 -0.00000000   -1.00880558   -0.35666663
 H                 -0.87365126    0.50440279   -0.35666663
 H                  0.87365126    0.50440279   -0.35666663

 1 2 1.0 3 1.0 4 1.0 5 1.0
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