HMDB0038104 RDKit 3D Isolinderenolide 58 58 0 0 0 0 0 0 0 0999 V2000 -8.9303 2.9046 -0.3642 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6677 2.6353 -0.0756 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5256 3.1719 -0.6258 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4037 2.3806 -0.3713 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2164 2.5752 -0.7234 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8526 1.2361 0.4075 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2394 0.0864 0.5979 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9382 -0.2262 0.0173 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9728 -0.4727 1.1653 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5849 -0.8037 0.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5939 -2.0426 -0.1302 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2074 -2.4312 -0.6193 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3946 -1.3479 -1.4539 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7534 -1.7657 -1.9297 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6617 -2.0401 -0.7678 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8411 -0.8055 0.1333 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7486 -1.2223 1.2035 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8993 -0.6374 1.4112 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3913 0.4696 0.6167 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7019 0.0940 -0.0552 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2208 1.2411 -0.8843 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4732 2.4744 -0.0497 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1934 1.6440 0.9583 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0842 0.5993 0.9876 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1634 3.6342 -1.1243 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7418 2.4174 0.1368 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7418 -0.6430 1.2151 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5560 0.4158 -0.7598 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0315 -1.2496 -0.4762 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9386 0.4378 1.8236 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3327 -1.3082 1.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1953 0.0756 0.1511 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9436 -0.9036 1.6012 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1789 -1.8425 -1.0599 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0021 -2.8872 0.4331 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3203 -3.3256 -1.2481 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4662 -2.6521 0.2444 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4528 -0.3571 -0.9575 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2287 -1.2095 -2.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 -0.9171 -2.5137 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7172 -2.6016 -2.6518 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3964 -2.9403 -0.2049 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6678 -2.2869 -1.2356 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8064 -0.6000 0.5115 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1489 -0.0156 -0.5288 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4044 -2.0696 1.8354 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5446 -0.9889 2.2283 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7443 0.9623 -0.0851 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6887 1.2838 1.3606 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4983 -0.7433 -0.7619 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4527 -0.2466 0.6586 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5355 1.4791 -1.7014 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1852 0.9335 -1.3248 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2531 2.2920 0.7141 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9038 3.2417 -0.7431 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5708 2.9063 0.3836 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0731 2.1417 1.9398 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8830 -0.1502 0.4027 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 3 4 1 0 4 5 2 0 4 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 6 23 1 0 23 24 1 0 23 2 1 0 1 25 1 0 1 26 1 0 7 27 1 0 8 28 1 0 8 29 1 0 9 30 1 0 9 31 1 0 10 32 1 0 10 33 1 0 11 34 1 0 11 35 1 0 12 36 1 0 12 37 1 0 13 38 1 0 13 39 1 0 14 40 1 0 14 41 1 0 15 42 1 0 15 43 1 0 16 44 1 0 16 45 1 0 17 46 1 0 18 47 1 0 19 48 1 0 19 49 1 0 20 50 1 0 20 51 1 0 21 52 1 0 21 53 1 0 22 54 1 0 22 55 1 0 22 56 1 0 23 57 1 0 24 58 1 0 M END