@MOLECULE 2-deoxy-d-xylo-hexonic acid 24 23 0 0 0 SMALL GASTEIGER @ATOM 1 O -1.1232 1.8048 0.6923 O.3 1 UNL1111111111 -0.5641 2 O 1.4923 1.9825 -0.0871 O.3 1 UNL1111111111 -0.5718 3 O -1.8936 0.0939 -1.4310 O.3 1 UNL1111111111 -0.5592 4 O -3.4971 -1.5066 0.3683 O.3 1 UNL1111111111 -0.5420 5 O 2.6136 -2.0779 -0.0825 O.3 1 UNL1111111111 -0.5421 6 O 2.6747 -0.1733 1.0752 O.2 1 UNL1111111111 -0.5406 7 C -0.4025 0.6237 0.3952 C.3 1 UNL1111111111 0.0289 8 C 0.6892 0.9735 -0.6448 C.3 1 UNL1111111111 0.1314 9 C -1.4572 -0.3456 -0.1649 C.3 1 UNL1111111111 0.0738 10 C 1.5338 -0.2381 -1.0634 C.3 1 UNL1111111111 -0.4195 11 C -2.6625 -0.4476 0.7828 C.3 1 UNL1111111111 -0.0403 12 C 2.3155 -0.7715 0.0885 C.2 1 UNL1111111111 0.6605 13 H 0.0417 0.2496 1.3444 H 1 UNL1111111111 0.1437 14 H 0.2375 1.4717 -1.5377 H 1 UNL1111111111 0.1690 15 H -1.0321 -1.3522 -0.3826 H 1 UNL1111111111 0.1568 16 H 0.8964 -1.0217 -1.5328 H 1 UNL1111111111 0.2055 17 H 2.2423 0.0673 -1.8710 H 1 UNL1111111111 0.2029 18 H -2.3723 -0.7269 1.8115 H 1 UNL1111111111 0.1503 19 H -3.2471 0.4905 0.8110 H 1 UNL1111111111 0.1399 20 H -0.4963 2.5626 0.7808 H 1 UNL1111111111 0.3461 21 H 2.0874 1.6125 0.6102 H 1 UNL1111111111 0.3522 22 H -2.2340 1.0156 -1.3685 H 1 UNL1111111111 0.3334 23 H -3.7042 -1.4122 -0.5872 H 1 UNL1111111111 0.3233 24 H 3.1524 -2.4667 0.6546 H 1 UNL1111111111 0.3619 @BOND 1 1 7 1 2 1 20 1 3 2 8 1 4 2 21 1 5 3 9 1 6 3 22 1 7 4 11 1 8 4 23 1 9 5 12 1 10 5 24 1 11 6 12 2 12 7 8 1 13 7 9 1 14 7 13 1 15 8 10 1 16 8 14 1 17 9 11 1 18 9 15 1 19 10 12 1 20 10 16 1 21 10 17 1 22 11 18 1 23 11 19 1