%chk=\\icnas2.cc.ic.ac.uk\lcl114\Desktop\Y3 TS Comp Lab\Exercise 1 -Reaction of Butadiene with Ethylene\Butadiene Opt GF.chk
# opt freq pm6 geom=connectivity integral=grid=ultrafine pop=full gfprint

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0 1
 C                 -0.74622030   -0.41650573   -0.15910264
 C                 -1.51357747    0.91869574   -0.15910264
 H                 -2.58357747    0.91869574   -0.15910264
 C                 -0.83830316    2.09367304   -0.15910264
 H                 -1.33925962    3.00286802    0.10033348
 H                  0.19937863    2.11224672   -0.41943227
 H                 -1.21540440   -1.23288606   -0.15910264
 C                  0.60897970   -0.41650573   -0.15910264
 H                  1.14764590   -1.34102654   -0.15910264
 H                  1.14214345    0.51119919   -0.15910264

 1 2 1.0 7 1.0 8 2.0
 2 3 1.0 4 2.0
 3
 4 5 1.0 6 1.0
 5
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 7
 8 9 1.0 10 1.0
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