@MOLECULE 4-hydroxy-5-methylene-3-[(Z)-tetradec-6-enoyl]furan-2-one 51 51 0 0 0 SMALL GASTEIGER @ATOM 1 O 2.4457 -0.6920 -1.7961 O.2 1 UNL111111111 -0.4421 2 O 5.7696 -0.3543 1.4414 O.3 1 UNL111111111 -0.3563 3 O 4.8647 -2.1564 -1.5172 O.2 1 UNL111111111 -0.3243 4 O 4.1084 1.1110 1.8022 O.2 1 UNL111111111 -0.3831 5 C -5.0330 -0.0125 0.7416 C.3 1 UNL111111111 -0.2735 6 C -6.1720 -0.6749 -0.0441 C.3 1 UNL111111111 -0.2734 7 C -4.7082 1.3686 0.1604 C.3 1 UNL111111111 -0.2605 8 C -6.5023 -2.0543 0.5395 C.3 1 UNL111111111 -0.2721 9 C -3.5413 2.0152 0.9239 C.3 1 UNL111111111 -0.2811 10 C -0.1882 2.3417 -0.3954 C.3 1 UNL111111111 -0.2614 11 C -7.6383 -2.7206 -0.2478 C.3 1 UNL111111111 -0.2514 12 C 0.6727 1.2440 -1.0279 C.3 1 UNL111111111 -0.2515 13 C -1.4650 2.5578 -1.2237 C.3 1 UNL111111111 -0.2798 14 C -3.2406 3.3637 0.3540 C.2 1 UNL111111111 -0.1641 15 C 1.9353 1.0026 -0.1983 C.3 1 UNL111111111 -0.3719 16 C -2.3229 3.6039 -0.5876 C.2 1 UNL111111111 -0.1674 17 C -7.9693 -4.0963 0.3310 C.3 1 UNL111111111 -0.4401 18 C 2.7720 -0.0920 -0.8004 C.2 1 UNL111111111 0.5153 19 C 4.0276 -0.4143 -0.1186 C.2 1 UNL111111111 -0.4460 20 C 4.9509 -1.3553 -0.4717 C.2 1 UNL111111111 0.3394 21 C 4.5145 0.2439 1.0961 C.2 1 UNL111111111 0.6028 22 C 6.0670 -1.3294 0.5124 C.2 1 UNL111111111 0.1180 23 C 7.1842 -2.0442 0.5989 C.2 1 UNL111111111 -0.3328 24 H -4.1329 -0.6570 0.7174 H 1 UNL111111111 0.1378 25 H -5.3124 0.0803 1.8077 H 1 UNL111111111 0.1362 26 H -7.0702 -0.0303 -0.0254 H 1 UNL111111111 0.1359 27 H -5.8902 -0.7721 -1.1092 H 1 UNL111111111 0.1373 28 H -4.4517 1.2825 -0.9123 H 1 UNL111111111 0.1402 29 H -5.5985 2.0225 0.2064 H 1 UNL111111111 0.1376 30 H -5.6035 -2.6983 0.5234 H 1 UNL111111111 0.1368 31 H -6.7862 -1.9583 1.6039 H 1 UNL111111111 0.1357 32 H -2.6523 1.3537 0.8842 H 1 UNL111111111 0.1480 33 H -3.7937 2.1001 1.9998 H 1 UNL111111111 0.1411 34 H 0.3807 3.2877 -0.3255 H 1 UNL111111111 0.1391 35 H -0.4542 2.0740 0.6447 H 1 UNL111111111 0.1407 36 H -7.3546 -2.8170 -1.3128 H 1 UNL111111111 0.1339 37 H -8.5384 -2.0775 -0.2312 H 1 UNL111111111 0.1334 38 H 0.9477 1.5154 -2.0660 H 1 UNL111111111 0.1483 39 H 0.0954 0.3023 -1.1196 H 1 UNL111111111 0.1500 40 H -1.1986 2.8524 -2.2585 H 1 UNL111111111 0.1413 41 H -2.0171 1.6011 -1.3268 H 1 UNL111111111 0.1491 42 H -3.8437 4.1718 0.7667 H 1 UNL111111111 0.1393 43 H 2.5315 1.9366 -0.1149 H 1 UNL111111111 0.1774 44 H 1.6701 0.7427 0.8492 H 1 UNL111111111 0.1780 45 H -2.1454 4.6158 -0.9495 H 1 UNL111111111 0.1390 46 H -8.2864 -4.0249 1.3773 H 1 UNL111111111 0.1420 47 H -7.1022 -4.7652 0.2942 H 1 UNL111111111 0.1423 48 H -8.7801 -4.5775 -0.2269 H 1 UNL111111111 0.1397 49 H 5.6543 -2.7716 -1.5899 H 1 UNL111111111 0.3264 50 H 7.9060 -1.8947 1.3958 H 1 UNL111111111 0.1888 51 H 7.4745 -2.8178 -0.0914 H 1 UNL111111111 0.1618 @BOND 1 1 18 2 2 2 21 1 3 2 22 1 4 3 20 1 5 3 49 1 6 4 21 2 7 5 6 1 8 5 7 1 9 5 24 1 10 5 25 1 11 6 8 1 12 6 26 1 13 6 27 1 14 7 9 1 15 7 28 1 16 7 29 1 17 8 11 1 18 8 30 1 19 8 31 1 20 9 14 1 21 9 32 1 22 9 33 1 23 10 12 1 24 10 13 1 25 10 34 1 26 10 35 1 27 11 17 1 28 11 36 1 29 11 37 1 30 12 15 1 31 12 38 1 32 12 39 1 33 13 16 1 34 13 40 1 35 13 41 1 36 14 16 2 37 14 42 1 38 15 18 1 39 15 43 1 40 15 44 1 41 16 45 1 42 17 46 1 43 17 47 1 44 17 48 1 45 18 19 1 46 19 20 2 47 19 21 1 48 20 22 1 49 22 23 2 50 23 50 1 51 23 51 1