@MOLECULE 6-chloro-6-deoxy-1,2-o-isopropylidene-alpha-d-glucofuranose 30 31 0 0 0 SMALL GASTEIGER @ATOM 1 CL -4.2317 0.9533 0.3292 Cl 1 UNL1111111111 -0.1609 2 O -0.0607 0.9408 0.2374 O.3 1 UNL1111111111 -0.4259 3 O 2.7477 -0.8392 0.2839 O.3 1 UNL1111111111 -0.4556 4 O 2.2025 1.3878 0.3404 O.3 1 UNL1111111111 -0.4611 5 O -0.3903 -2.2986 0.6634 O.3 1 UNL1111111111 -0.5651 6 O -2.4273 -1.4953 -0.9328 O.3 1 UNL1111111111 -0.5514 7 C 1.4792 -0.7746 0.8932 C.3 1 UNL1111111111 -0.0089 8 C 0.4259 -1.3954 -0.0498 C.3 1 UNL1111111111 0.0696 9 C 1.1246 0.7322 0.9623 C.3 1 UNL1111111111 0.2962 10 C -0.4590 -0.2114 -0.4956 C.3 1 UNL1111111111 0.0253 11 C 3.0851 0.4463 -0.2586 C.3 1 UNL1111111111 0.5048 12 C -1.9605 -0.4026 -0.1682 C.3 1 UNL1111111111 0.1323 13 C 2.8853 0.4281 -1.7645 C.3 1 UNL1111111111 -0.5134 14 C 4.4939 0.7744 0.2023 C.3 1 UNL1111111111 -0.4954 15 C -2.7560 0.8019 -0.6517 C.3 1 UNL1111111111 -0.2040 16 H 1.5691 -1.2901 1.8640 H 1 UNL1111111111 0.1661 17 H 0.8945 -1.9275 -0.9045 H 1 UNL1111111111 0.1496 18 H 0.9725 1.2351 1.9325 H 1 UNL1111111111 0.1619 19 H -0.3076 0.0273 -1.5696 H 1 UNL1111111111 0.1493 20 H -2.1033 -0.6097 0.9179 H 1 UNL1111111111 0.1589 21 H 3.3088 1.3281 -2.2282 H 1 UNL1111111111 0.1693 22 H 3.3652 -0.4487 -2.2156 H 1 UNL1111111111 0.1668 23 H 1.8204 0.4065 -2.0275 H 1 UNL1111111111 0.1667 24 H 4.5942 0.6421 1.2885 H 1 UNL1111111111 0.1713 25 H 5.2324 0.1229 -0.2793 H 1 UNL1111111111 0.1657 26 H 4.7467 1.8183 -0.0250 H 1 UNL1111111111 0.1708 27 H 0.1101 -3.1075 0.8991 H 1 UNL1111111111 0.3327 28 H -3.0838 0.6806 -1.6998 H 1 UNL1111111111 0.1736 29 H -2.2035 1.7509 -0.5344 H 1 UNL1111111111 0.1743 30 H -2.0819 -2.3312 -0.5447 H 1 UNL1111111111 0.3364 @BOND 1 1 15 1 2 2 9 1 3 2 10 1 4 3 7 1 5 3 11 1 6 4 9 1 7 4 11 1 8 5 8 1 9 5 27 1 10 6 12 1 11 6 30 1 12 7 8 1 13 7 9 1 14 7 16 1 15 8 10 1 16 8 17 1 17 9 18 1 18 10 12 1 19 10 19 1 20 11 13 1 21 11 14 1 22 12 15 1 23 12 20 1 24 13 21 1 25 13 22 1 26 13 23 1 27 14 24 1 28 14 25 1 29 14 26 1 30 15 28 1 31 15 29 1