@MOLECULE 1-deoxy-l-mannitol 25 24 0 0 0 SMALL GASTEIGER @ATOM 1 C 2.7129 0.0786 0.5817 C.3 1 UNL1111111111 -0.0565 2 C 1.4723 0.1192 -0.3201 C.3 1 UNL1111111111 0.0815 3 C 0.2034 -0.2457 0.4801 C.3 1 UNL1111111111 0.0685 4 C -1.0421 -0.2364 -0.4322 C.3 1 UNL1111111111 0.0386 5 C -2.3080 0.1653 0.3629 C.3 1 UNL1111111111 0.1232 6 C -3.5281 0.2236 -0.5470 C.3 1 UNL1111111111 -0.4964 7 O 3.8010 0.0919 -0.3312 O.3 1 UNL1111111111 -0.5652 8 O 1.2425 1.4411 -0.7714 O.3 1 UNL1111111111 -0.5686 9 O 0.3761 -1.5180 1.0580 O.3 1 UNL1111111111 -0.5472 10 O -1.2174 -1.5117 -1.0054 O.3 1 UNL1111111111 -0.5410 11 O -2.0894 1.4071 0.9904 O.3 1 UNL1111111111 -0.5494 12 H 2.7773 0.9694 1.2314 H 1 UNL1111111111 0.1337 13 H 2.7459 -0.8412 1.1935 H 1 UNL1111111111 0.1389 14 H 1.6062 -0.5340 -1.2130 H 1 UNL1111111111 0.1473 15 H 0.0695 0.4271 1.3617 H 1 UNL1111111111 0.1799 16 H -0.8899 0.4208 -1.3205 H 1 UNL1111111111 0.1700 17 H -2.4693 -0.5116 1.2344 H 1 UNL1111111111 0.1480 18 H -4.4243 0.5118 0.0166 H 1 UNL1111111111 0.1602 19 H -3.4024 0.9511 -1.3569 H 1 UNL1111111111 0.1538 20 H -3.7190 -0.7508 -1.0158 H 1 UNL1111111111 0.1634 21 H 4.6481 -0.0081 0.1418 H 1 UNL1111111111 0.3194 22 H 2.0616 1.7884 -1.1885 H 1 UNL1111111111 0.3385 23 H 0.5355 -2.1955 0.3626 H 1 UNL1111111111 0.3222 24 H -1.5243 -2.1567 -0.3313 H 1 UNL1111111111 0.3171 25 H -1.8857 2.1073 0.3375 H 1 UNL1111111111 0.3203 @BOND 1 1 2 1 2 1 7 1 3 1 12 1 4 1 13 1 5 2 3 1 6 2 8 1 7 2 14 1 8 3 4 1 9 3 9 1 10 3 15 1 11 4 5 1 12 4 10 1 13 4 16 1 14 5 6 1 15 5 11 1 16 5 17 1 17 6 18 1 18 6 19 1 19 6 20 1 20 7 21 1 21 8 22 1 22 9 23 1 23 10 24 1 24 11 25 1