@MOLECULE (1s,2s,3r,4r,5r,6r)-3,5,6-trihydroxy-1,2,4-cyclohexanetriyl tris[dihydrogen (phosphate)] 39 39 0 0 0 SMALL GASTEIGER @ATOM 1 P 0.6371 -3.3676 -0.1978 P.3 1 UNL11 0.3740 2 P 3.4437 1.8195 -0.1747 P.3 1 UNL11 0.3723 3 P -4.0911 0.8475 -0.0726 P.3 1 UNL11 0.3380 4 O 0.2474 -1.8775 0.2323 O.3 1 UNL11 -0.3125 5 O 1.9467 1.2429 -0.1581 O.3 1 UNL11 -0.3410 6 O -2.5460 1.1809 -0.3119 O.3 1 UNL11 -0.2190 7 O -0.2823 1.0320 -1.7920 O.3 1 UNL11 -0.5652 8 O 0.2147 -0.3232 2.6110 O.3 1 UNL11 -0.5529 9 O -0.3909 2.5395 0.4333 O.3 1 UNL11 -0.5505 10 O 0.9402 -3.9746 1.2489 O.3 1 UNL11 -0.3665 11 O 2.0930 -3.1636 -0.8065 O.3 1 UNL11 -0.3251 12 O 3.5468 2.1491 -1.7164 O.3 1 UNL11 -0.2739 13 O 4.3484 0.5218 0.0325 O.3 1 UNL11 -0.3941 14 O -4.0536 -0.7290 0.2267 O.3 1 UNL11 -0.4403 15 O -4.6635 0.9590 -1.5501 O.3 1 UNL11 -0.3100 16 O -0.3610 -4.0527 -0.9911 O.2 1 UNL11 -0.2793 17 O 3.6624 2.9642 0.6849 O.2 1 UNL11 -0.2521 18 O -4.8197 1.6871 0.8563 O.2 1 UNL11 -0.2301 19 C 0.6922 -0.7048 -0.4812 C.3 1 UNL11 0.0611 20 C 1.4787 0.1138 0.5869 C.3 1 UNL11 0.0557 21 C -1.4764 0.4027 0.2596 C.3 1 UNL11 0.0293 22 C -0.6316 -0.0360 -0.9571 C.3 1 UNL11 0.1050 23 C 0.5821 0.6906 1.7099 C.3 1 UNL11 0.0516 24 C -0.6966 1.3754 1.1757 C.3 1 UNL11 0.0775 25 H 1.3427 -0.8645 -1.3745 H 1 UNL11 0.1622 26 H 2.2660 -0.5334 1.0463 H 1 UNL11 0.1627 27 H -1.7622 -0.4999 0.8573 H 1 UNL11 0.1652 28 H -1.2021 -0.7215 -1.6250 H 1 UNL11 0.1569 29 H 1.1519 1.4011 2.3575 H 1 UNL11 0.1590 30 H -1.3369 1.7312 2.0165 H 1 UNL11 0.1582 31 H -0.2320 1.8672 -1.2531 H 1 UNL11 0.3614 32 H 0.0797 -1.1811 2.1516 H 1 UNL11 0.3405 33 H 0.5572 2.7831 0.4961 H 1 UNL11 0.3376 34 H 0.0934 -4.4432 1.5899 H 1 UNL11 0.3255 35 H 2.5861 -4.0644 -0.7804 H 1 UNL11 0.3209 36 H 3.0360 1.4137 -2.2406 H 1 UNL11 0.3250 37 H 5.1909 0.7900 0.5472 H 1 UNL11 0.3297 38 H -4.9397 -1.0227 0.6248 H 1 UNL11 0.3288 39 H -4.0362 0.4561 -2.1904 H 1 UNL11 0.3143 @BOND 1 1 4 1 2 1 10 1 3 1 11 1 4 1 16 2 5 2 5 1 6 2 12 1 7 2 13 1 8 2 17 2 9 3 6 1 10 3 14 1 11 3 15 1 12 3 18 2 13 4 19 1 14 5 20 1 15 6 21 1 16 7 22 1 17 7 31 1 18 8 23 1 19 8 32 1 20 9 24 1 21 9 33 1 22 10 34 1 23 11 35 1 24 12 36 1 25 13 37 1 26 14 38 1 27 15 39 1 28 19 20 1 29 19 25 1 30 20 23 1 31 20 26 1 32 21 22 1 33 21 27 1 34 22 19 1 35 22 28 1 36 23 24 1 37 23 29 1 38 24 21 1 39 24 30 1