@MOLECULE (2r,3r,3as,4ar,5s,6s,7r,8ar,9as)-2,7,9a-tris(hydroxymethyl)octahydro-5h-furo[2,3-b]pyrano[3,2-e][1,4]dioxine-3,5,6-triol 42 44 0 0 0 SMALL GASTEIGER @ATOM 1 O 0.0544 1.3679 -1.1058 O.3 1 UNL1111111111 -0.4114 2 O 0.3513 -1.4363 -1.0943 O.3 1 UNL1111111111 -0.3623 3 O 1.7059 -0.7195 0.6079 O.3 1 UNL1111111111 -0.3828 4 O -1.0055 -0.6738 0.5420 O.3 1 UNL1111111111 -0.4128 5 O 3.4460 1.7891 -0.4902 O.3 1 UNL1111111111 -0.5447 6 O -3.3451 0.5181 -1.7861 O.3 1 UNL1111111111 -0.5520 7 O -1.7681 2.2035 0.9249 O.3 1 UNL1111111111 -0.5409 8 O 2.7606 -2.6486 -0.9125 O.3 1 UNL1111111111 -0.4819 9 O 1.6266 -0.0854 3.3218 O.3 1 UNL1111111111 -0.5258 10 O -2.9489 -2.4224 1.3262 O.3 1 UNL1111111111 -0.5344 11 C 1.3608 0.8300 -1.1799 C.3 1 UNL1111111111 -0.0342 12 C 1.4793 -0.6691 -0.7828 C.3 1 UNL1111111111 0.3849 13 C -0.9740 0.5104 -1.5716 C.3 1 UNL1111111111 -0.0288 14 C 2.1275 1.5593 -0.0499 C.3 1 UNL1111111111 0.0784 15 C -0.8923 -0.8485 -0.8568 C.3 1 UNL1111111111 0.2628 16 C 2.2338 0.5181 1.0818 C.3 1 UNL1111111111 0.0218 17 C -2.2814 1.2359 -1.1952 C.3 1 UNL1111111111 0.0750 18 C -2.5586 1.2046 0.3262 C.3 1 UNL1111111111 0.0816 19 C -2.2378 -0.1474 0.9808 C.3 1 UNL1111111111 0.0107 20 C 2.6429 -1.3782 -1.5176 C.3 1 UNL1111111111 -0.0625 21 C 1.3967 0.8764 2.3168 C.3 1 UNL1111111111 -0.0344 22 C -3.3546 -1.1842 0.7850 C.3 1 UNL1111111111 -0.0524 23 H 1.7539 1.0427 -2.1915 H 1 UNL1111111111 0.1508 24 H -0.8688 0.3946 -2.6712 H 1 UNL1111111111 0.1426 25 H 1.6435 2.5067 0.2530 H 1 UNL1111111111 0.1418 26 H -1.6125 -1.6092 -1.2299 H 1 UNL1111111111 0.1587 27 H 3.2958 0.3036 1.3495 H 1 UNL1111111111 0.1774 28 H -2.2642 2.2901 -1.5518 H 1 UNL1111111111 0.1448 29 H -3.6043 1.5270 0.5425 H 1 UNL1111111111 0.1650 30 H -2.0175 -0.0053 2.0721 H 1 UNL1111111111 0.1801 31 H 3.5726 -0.7923 -1.3912 H 1 UNL1111111111 0.1397 32 H 2.4077 -1.5187 -2.5874 H 1 UNL1111111111 0.1303 33 H 0.3147 0.9015 2.0842 H 1 UNL1111111111 0.1358 34 H 1.7172 1.8269 2.7813 H 1 UNL1111111111 0.1458 35 H -3.6185 -1.3344 -0.2786 H 1 UNL1111111111 0.1392 36 H -4.2670 -0.9267 1.3519 H 1 UNL1111111111 0.1477 37 H 3.5303 2.6676 -0.9112 H 1 UNL1111111111 0.3233 38 H -3.5410 0.8513 -2.6848 H 1 UNL1111111111 0.3259 39 H -0.8172 2.0258 0.7227 H 1 UNL1111111111 0.3325 40 H 3.6424 -3.0278 -1.1095 H 1 UNL1111111111 0.3008 41 H 1.4031 -0.9779 2.9648 H 1 UNL1111111111 0.3319 42 H -1.9930 -2.5716 1.1270 H 1 UNL1111111111 0.3319 @BOND 1 1 11 1 2 1 13 1 3 2 12 1 4 2 15 1 5 3 12 1 6 3 16 1 7 4 15 1 8 4 19 1 9 5 14 1 10 5 37 1 11 6 17 1 12 6 38 1 13 7 18 1 14 7 39 1 15 8 20 1 16 8 40 1 17 9 21 1 18 9 41 1 19 10 22 1 20 10 42 1 21 11 12 1 22 11 14 1 23 11 23 1 24 12 20 1 25 13 15 1 26 13 17 1 27 13 24 1 28 14 16 1 29 14 25 1 30 15 26 1 31 16 21 1 32 16 27 1 33 17 18 1 34 17 28 1 35 18 19 1 36 18 29 1 37 19 22 1 38 19 30 1 39 20 31 1 40 20 32 1 41 21 33 1 42 21 34 1 43 22 35 1 44 22 36 1