@MOLECULE 2-o-methyl-1,6-di-o-phosphono-d-mannitol 39 38 0 0 0 SMALL GASTEIGER @ATOM 1 C 2.1325 -3.3947 -0.8093 C.3 1 UNL111111111 -0.1984 2 O 1.7251 -2.5522 0.2531 O.3 1 UNL111111111 -0.3791 3 C 1.9348 -1.1727 0.0030 C.3 1 UNL111111111 0.0093 4 C 3.2318 -0.7715 0.7436 C.3 1 UNL111111111 -0.0361 5 O 3.6938 0.3182 -0.0771 O.3 1 UNL111111111 -0.3859 6 P 5.1996 0.8804 -0.0196 P.3 1 UNL111111111 0.3629 7 O 6.2208 0.0552 0.5892 O.2 1 UNL111111111 -0.2383 8 O 5.3305 1.3125 -1.5533 O.3 1 UNL111111111 -0.3647 9 O 5.0227 2.3011 0.6636 O.3 1 UNL111111111 -0.2691 10 C 0.6891 -0.4787 0.5934 C.3 1 UNL111111111 0.0754 11 O 0.8065 0.9298 0.4958 O.3 1 UNL111111111 -0.5865 12 C -0.5637 -0.8296 -0.2340 C.3 1 UNL111111111 0.0965 13 O -0.4501 -0.3076 -1.5372 O.3 1 UNL111111111 -0.5616 14 C -1.8285 -0.2440 0.4336 C.3 1 UNL111111111 0.0767 15 O -1.9585 -1.0012 1.6242 O.3 1 UNL111111111 -0.5696 16 C -3.0580 -0.4475 -0.4686 C.3 1 UNL111111111 -0.0429 17 O -3.9478 0.5785 0.0156 O.3 1 UNL111111111 -0.3798 18 P -5.5470 0.4523 -0.0582 P.3 1 UNL111111111 0.3533 19 O -5.8875 1.6934 0.8930 O.3 1 UNL111111111 -0.3458 20 O -5.9696 1.0172 -1.4786 O.3 1 UNL111111111 -0.2905 21 O -6.1576 -0.8285 0.2312 O.2 1 UNL111111111 -0.2327 22 H 1.9148 -4.3982 -0.4212 H 1 UNL111111111 0.1474 23 H 1.5406 -3.2001 -1.7096 H 1 UNL111111111 0.1285 24 H 3.2024 -3.2864 -1.0105 H 1 UNL111111111 0.1261 25 H 2.0166 -0.9484 -1.0861 H 1 UNL111111111 0.1589 26 H 3.0364 -0.4114 1.7724 H 1 UNL111111111 0.1382 27 H 3.9234 -1.6362 0.7971 H 1 UNL111111111 0.1490 28 H 5.2730 0.4827 -2.1470 H 1 UNL111111111 0.3230 29 H 4.5640 2.9387 -0.0054 H 1 UNL111111111 0.3122 30 H 0.5400 -0.7255 1.6695 H 1 UNL111111111 0.1626 31 H 1.7462 1.2062 0.4381 H 1 UNL111111111 0.3470 32 H -0.6529 -1.9301 -0.3838 H 1 UNL111111111 0.1675 33 H -0.1156 0.6183 -1.4931 H 1 UNL111111111 0.3358 34 H -1.6938 0.8267 0.7107 H 1 UNL111111111 0.1522 35 H -2.8119 -0.7974 2.0575 H 1 UNL111111111 0.3319 36 H -2.8238 -0.2199 -1.5307 H 1 UNL111111111 0.1510 37 H -3.4358 -1.4860 -0.3908 H 1 UNL111111111 0.1477 38 H -5.2518 1.6808 1.6963 H 1 UNL111111111 0.3184 39 H -5.5916 1.9680 -1.5873 H 1 UNL111111111 0.3099 @BOND 1 1 22 1 2 1 23 1 3 1 24 1 4 2 1 1 5 3 2 1 6 3 4 1 7 3 25 1 8 4 26 1 9 4 27 1 10 5 4 1 11 5 6 1 12 6 8 1 13 6 9 1 14 7 6 2 15 8 28 1 16 9 29 1 17 10 3 1 18 10 30 1 19 11 10 1 20 11 31 1 21 12 10 1 22 12 13 1 23 12 32 1 24 13 33 1 25 14 12 1 26 14 34 1 27 15 14 1 28 15 35 1 29 16 14 1 30 16 17 1 31 16 36 1 32 16 37 1 33 18 17 1 34 18 19 1 35 19 38 1 36 20 18 1 37 20 39 1 38 21 18 2