@MOLECULE DB02811 19 18 1 SMALL USER_CHARGES @ATOM 1 P1 -0.3444 -0.0700 -0.0757 P 1 noname 0.0169 2 O1 1.0849 0.0078 0.0809 O.2 1 noname -0.2328 3 O2 -1.1437 1.1821 -0.4822 O.3 1 noname -0.1862 4 O3 -1.0738 -1.4051 0.1633 O.3 1 noname -0.1862 5 C1 -1.5480 1.8847 0.6836 C.3 1 noname 0.0572 6 C2 -1.1392 -2.1332 -1.0541 C.3 1 noname 0.0572 7 C3 -2.3421 3.1285 0.2798 C.3 1 noname -0.0406 8 C4 -1.8638 -3.4597 -0.8166 C.3 1 noname -0.0406 9 H1 1.0055 0.0034 0.0722 H 1 noname 0.1739 10 H2 -2.2226 1.2098 1.2105 H 1 noname 0.0573 11 H3 -0.6244 2.2136 1.1599 H 1 noname 0.0573 12 H4 -1.7524 -1.5283 -1.7221 H 1 noname 0.0573 13 H5 -0.1048 -2.3557 -1.3158 H 1 noname 0.0573 14 H6 -2.6767 3.6526 1.1751 H 1 noname 0.0254 15 H7 -1.7076 3.7885 -0.3117 H 1 noname 0.0254 16 H8 -3.2079 2.8307 -0.3117 H 1 noname 0.0254 17 H9 -1.9594 -3.6347 0.2550 H 1 noname 0.0254 18 H10 -2.8552 -3.4180 -1.2678 H 1 noname 0.0254 19 H11 -1.2931 -4.2713 -1.2678 H 1 noname 0.0254 @BOND 1 1 2 2 2 1 3 1 3 1 4 1 4 3 5 1 5 4 6 1 6 5 7 1 7 6 8 1 8 1 9 1 9 5 10 1 10 5 11 1 11 6 12 1 12 6 13 1 13 7 14 1 14 7 15 1 15 7 16 1 16 8 17 1 17 8 18 1 18 8 19 1 @SUBSTRUCTURE 1 noname 1