@MOLECULE 3-methyl-1,2-pentadiene 16 15 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.9436 0.9088 0.0021 C.3 1 UNL111111111 -0.2476 2 C 0.0883 -0.1840 0.0002 C.2 1 UNL111111111 -0.0176 3 C -2.3904 0.4175 -0.0016 C.3 1 UNL111111111 -0.4298 4 C -0.3397 -1.6138 0.0006 C.3 1 UNL111111111 -0.4244 5 C 1.3624 0.1219 -0.0014 C.1 1 UNL111111111 -0.0596 6 C 2.6279 0.4227 -0.0002 C.2 1 UNL111111111 -0.3393 7 H -0.7779 1.5663 -0.8794 H 1 UNL111111111 0.1482 8 H -0.7805 1.5604 0.8885 H 1 UNL111111111 0.1482 9 H -3.0900 1.2616 -0.0017 H 1 UNL111111111 0.1416 10 H -2.6083 -0.1886 -0.8882 H 1 UNL111111111 0.1451 11 H -2.6119 -0.1916 0.8820 H 1 UNL111111111 0.1450 12 H 0.5153 -2.3047 0.0004 H 1 UNL111111111 0.1524 13 H -0.9448 -1.8470 0.8884 H 1 UNL111111111 0.1561 14 H -0.9454 -1.8472 -0.8868 H 1 UNL111111111 0.1561 15 H 3.2096 0.5610 -0.9019 H 1 UNL111111111 0.1628 16 H 3.2081 0.5594 0.9026 H 1 UNL111111111 0.1628 @BOND 1 15 6 1 2 10 3 1 3 14 4 1 4 7 1 1 5 9 3 1 6 3 1 1 7 3 11 1 8 5 6 2 9 5 2 2 10 6 16 1 11 2 4 1 12 2 1 1 13 12 4 1 14 4 13 1 15 1 8 1