@MOLECULE (1r,2s,3r,4s)-2,3-dimethyl-7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid 29 30 0 0 0 SMALL GASTEIGER @ATOM 1 O -1.2268 2.3850 -0.6811 O.2 1 UNL1111111111 -0.2771 2 C -1.1012 1.4339 0.0397 C.2 1 UNL1111111111 0.0134 3 O -2.1740 0.9002 0.6882 O.3 1 UNL1111111111 -0.4185 4 C 0.1715 0.7411 0.4772 C.3 1 UNL1111111111 0.5889 5 C 0.4599 1.2911 1.8676 C.3 1 UNL1111111111 -0.9304 6 C 0.0922 -0.8267 0.3796 C.3 1 UNL1111111111 0.7125 7 C 0.2315 -1.5667 1.6975 C.3 1 UNL1111111111 -1.1169 8 C -1.1891 -1.3234 -0.2648 C.2 1 UNL1111111111 -0.0291 9 O -1.8432 -2.2826 0.0505 O.2 1 UNL1111111111 -0.2770 10 O -1.5217 -0.5868 -1.3529 O.3 1 UNL1111111111 -0.4504 11 C 1.3006 1.0564 -0.5754 C.3 1 UNL1111111111 -0.3301 12 C 2.6938 0.6934 -0.0043 C.3 1 UNL1111111111 -0.4242 13 C 2.6376 -0.8579 -0.0186 C.3 1 UNL1111111111 -0.5049 14 C 1.2480 -1.1176 -0.6527 C.3 1 UNL1111111111 -0.2976 15 O 1.1038 0.0052 -1.5344 O.3 1 UNL1111111111 -0.0354 16 H -3.0343 1.3105 0.4282 H 1 UNL1111111111 0.3615 17 H -0.3767 1.0951 2.5562 H 1 UNL1111111111 0.2568 18 H 1.3535 0.8436 2.3182 H 1 UNL1111111111 0.2524 19 H 0.6174 2.3785 1.8437 H 1 UNL1111111111 0.2687 20 H -0.6292 -1.3699 2.3562 H 1 UNL1111111111 0.3026 21 H 0.2552 -2.6564 1.5421 H 1 UNL1111111111 0.2919 22 H 1.1359 -1.2935 2.2496 H 1 UNL1111111111 0.2983 23 H -2.3496 -0.8962 -1.8000 H 1 UNL1111111111 0.3842 24 H 1.2066 2.0154 -1.0961 H 1 UNL1111111111 0.2507 25 H 3.4881 1.0728 -0.6667 H 1 UNL1111111111 0.2221 26 H 2.8890 1.1096 0.9892 H 1 UNL1111111111 0.1902 27 H 3.4353 -1.2839 -0.6461 H 1 UNL1111111111 0.2327 28 H 2.7502 -1.2971 0.9790 H 1 UNL1111111111 0.2094 29 H 1.1422 -2.0338 -1.2386 H 1 UNL1111111111 0.2552 @BOND 1 1 2 2 2 2 3 1 3 2 4 1 4 3 16 1 5 4 5 1 6 4 6 1 7 4 11 1 8 5 17 1 9 5 18 1 10 5 19 1 11 6 7 1 12 6 8 1 13 6 14 1 14 7 20 1 15 7 21 1 16 7 22 1 17 8 9 2 18 8 10 1 19 10 23 1 20 11 12 1 21 11 15 1 22 11 24 1 23 12 13 1 24 12 25 1 25 12 26 1 26 13 14 1 27 13 27 1 28 13 28 1 29 14 15 1 30 14 29 1