@MOLECULE (2s)-2,3,3-trihydroxy-6-methyl-4-oxoheptyl dihydrogen phosphate 34 33 0 0 0 SMALL GASTEIGER @ATOM 1 O 4.0702 1.1770 0.7320 O.2 1 UNL111111111 -0.2626 2 P 3.7930 -0.1533 0.2244 P.3 1 UNL111111111 0.3418 3 O 4.4301 -0.5416 -1.1936 O.3 1 UNL111111111 -0.4135 4 O 4.2714 -1.3113 1.2030 O.3 1 UNL111111111 -0.2869 5 O 2.2872 -0.6467 0.0006 O.3 1 UNL111111111 -0.2511 6 C 1.3493 0.1695 -0.7384 C.3 1 UNL111111111 -0.0546 7 C 0.0207 -0.1812 -0.0453 C.3 1 UNL111111111 0.0872 8 O -0.5154 -1.3849 -0.5197 O.3 1 UNL111111111 -0.5459 9 C -1.0241 0.9346 -0.2965 C.3 1 UNL111111111 0.3559 10 O -0.5064 2.1384 0.1834 O.3 1 UNL111111111 -0.5818 11 O -1.2095 1.0580 -1.6818 O.3 1 UNL111111111 -0.5954 12 C -2.4140 0.6336 0.3230 C.2 1 UNL111111111 0.4305 13 O -2.7097 1.2411 1.3218 O.2 1 UNL111111111 -0.4614 14 C -3.2673 -0.3615 -0.3759 C.3 1 UNL111111111 -0.3926 15 C -4.7147 -0.3738 0.1485 C.3 1 UNL111111111 -0.0357 16 C -5.6194 -1.0957 -0.8567 C.3 1 UNL111111111 -0.4597 17 C -4.7848 -1.0609 1.5154 C.3 1 UNL111111111 -0.4568 18 H 5.2960 -0.0190 -1.3286 H 1 UNL111111111 0.3247 19 H 3.9607 -2.2172 0.8238 H 1 UNL111111111 0.3131 20 H 1.5271 1.2662 -0.7122 H 1 UNL111111111 0.1626 21 H 1.3612 -0.1780 -1.7920 H 1 UNL111111111 0.1389 22 H 0.1586 -0.3697 1.0474 H 1 UNL111111111 0.1828 23 H -0.5920 -1.3756 -1.5013 H 1 UNL111111111 0.3282 24 H -1.0548 2.5044 0.9246 H 1 UNL111111111 0.3669 25 H -0.9550 1.9569 -1.9935 H 1 UNL111111111 0.3572 26 H -3.2547 -0.1611 -1.4715 H 1 UNL111111111 0.1858 27 H -2.8137 -1.3765 -0.2717 H 1 UNL111111111 0.1989 28 H -5.0652 0.6827 0.2596 H 1 UNL111111111 0.1409 29 H -5.2980 -2.1302 -1.0189 H 1 UNL111111111 0.1461 30 H -6.6550 -1.1285 -0.4989 H 1 UNL111111111 0.1475 31 H -5.6263 -0.5916 -1.8287 H 1 UNL111111111 0.1420 32 H -4.4764 -2.1096 1.4616 H 1 UNL111111111 0.1431 33 H -4.1329 -0.5572 2.2420 H 1 UNL111111111 0.1606 34 H -5.8020 -1.0346 1.9209 H 1 UNL111111111 0.1433 @BOND 1 1 2 2 2 2 4 1 3 2 3 1 4 2 5 1 5 3 18 1 6 4 19 1 7 5 6 1 8 6 20 1 9 6 21 1 10 7 9 1 11 7 6 1 12 7 22 1 13 8 7 1 14 8 23 1 15 9 11 1 16 10 9 1 17 10 24 1 18 11 25 1 19 12 13 2 20 12 9 1 21 14 12 1 22 14 26 1 23 14 27 1 24 15 14 1 25 15 17 1 26 15 28 1 27 16 15 1 28 16 29 1 29 16 30 1 30 16 31 1 31 17 32 1 32 17 33 1 33 17 34 1