TITLE = "3D CONVEX SHELL" VARIABLES = "X" "Y" "Z" "U" ZONE T="dimethyl_bromomalonate", N=17, E=46, DATAPACKING=POINT, ZONETYPE=FETRIANGLE 0.1684 0.0862 -0.6343 9 -0.782 1.223 -0.3596 7 1.4571 0.3173 0.1119 7 -0.6406 -1.6032 -0.0372 2 -1.9718 0.9798 0.2121 6 -0.4729 2.3533 -0.654 3 2.6131 0.4236 -0.5619 6 1.4498 0.407 1.3168 2 -2.8875 2.0751 0.4768 9 3.8548 0.6463 0.1571 9 0.3723 0.0334 -1.7037 5 -3.142 2.5705 -0.4602 2 -3.7944 1.6866 0.9403 4 -2.4137 2.7904 1.149 3 3.7888 1.58 0.7156 3 4.0276 -0.1788 0.8479 3 4.6801 0.705 -0.5526 6 10 16 17 10 16 17 10 15 16 10 15 17 10 15 17 7 10 15 7 10 17 7 10 17 7 10 16 3 7 16 3 8 16 3 7 15 3 8 15 2 3 8 2 3 6 1 2 8 1 2 5 1 2 5 1 4 5 1 4 5 1 2 11 1 4 11 1 4 11 1 3 11 1 3 11 3 7 11 3 7 11 1 6 11 1 3 6 1 3 8 2 6 11 2 6 12 2 5 12 5 9 12 9 12 13 9 12 13 9 13 14 9 13 14 9 12 14 5 9 13 5 9 13 5 9 14 2 5 14 2 6 14 8 15 16 6 12 14