Simple example of a A + B -> C reaction. See source for further information. 88 taken from Vollhardt and Schore cycloaddition 88 one step 1 Acetonitrile 100 3 reflux 2 workup C6 H10 1 5.4000 -3.4000 0.0000 C 2 5.3958 -4.2250 0.0000 C 3 5.9833 -2.8125 0.0000 C 4 4.8083 -4.8083 0.0000 C 5 5.9792 -4.8083 0.0000 C 6 4.8125 -2.8125 0.0000 C 1 1 2 1 2 2 4 1 3 2 5 2 4 1 3 2 5 1 6 1 C3 H4 O 1 0.9083 -1.3750 0.0000 C 2 0.9042 -2.2000 0.0000 C 3 0.3208 -0.7875 0.0000 H 4 1.4917 -0.7875 0.0000 C 5 1.4875 0.0375 0.0000 O 1 1 3 1 2 1 2 2 3 1 4 1 4 4 5 2 C9 H14 O 1 4.0375 0.9292 0.0000 C 2 4.0333 0.1042 0.0000 C 3 4.7418 -0.3096 0.0000 C 4 5.4589 0.0970 0.0000 C 5 5.4631 0.9220 0.0000 C 6 4.7501 1.3404 0.0000 C 7 3.3208 1.3417 0.0000 C 8 3.3167 -0.3042 0.0000 C 9 6.1750 1.3417 0.0000 C 10 6.1708 2.1667 0.0000 O 1 4 5 1 2 5 6 1 3 1 2 2 4 1 7 1 5 1 6 1 6 2 8 1 7 2 3 1 8 5 9 1 9 3 4 1 10 9 10 2