@MOLECULE (3e,4s)-4-hydroxy-5-methylene-3-tetradecylidenedihydro-2(3h)-furanone 54 54 0 0 0 SMALL GASTEIGER @ATOM 1 O -5.5572 -2.0676 -0.7993 O.3 1 UNL1111111111 -0.3562 2 O -3.7377 -0.6212 1.7100 O.3 1 UNL1111111111 -0.5201 3 O -5.4382 -0.6759 -2.5429 O.2 1 UNL1111111111 -0.4091 4 C 2.2797 1.4702 -0.0329 C.3 1 UNL1111111111 -0.2717 5 C 3.2717 0.3195 0.1831 C.3 1 UNL1111111111 -0.2727 6 C 0.8489 1.0140 0.2796 C.3 1 UNL1111111111 -0.2708 7 C 4.7040 0.7741 -0.1244 C.3 1 UNL1111111111 -0.2721 8 C -0.1549 2.1546 0.0649 C.3 1 UNL1111111111 -0.2765 9 C 5.6949 -0.3778 0.0867 C.3 1 UNL1111111111 -0.2719 10 C -1.5790 1.6663 0.3545 C.3 1 UNL1111111111 -0.2722 11 C 7.1282 0.0785 -0.2139 C.3 1 UNL1111111111 -0.2748 12 C -2.5934 2.8090 0.2199 C.3 1 UNL1111111111 -0.2565 13 C 8.1180 -1.0757 -0.0118 C.3 1 UNL1111111111 -0.2721 14 C -4.0146 2.3091 0.5261 C.3 1 UNL1111111111 -0.3128 15 C 9.5537 -0.6188 -0.3025 C.3 1 UNL1111111111 -0.2511 16 C -4.4722 1.3736 -0.5377 C.2 1 UNL1111111111 0.0451 17 C -4.8690 0.1186 -0.3093 C.2 1 UNL1111111111 -0.3174 18 C 10.5430 -1.7663 -0.0978 C.3 1 UNL1111111111 -0.4397 19 C -4.9458 -0.6227 0.9982 C.3 1 UNL1111111111 0.1329 20 C -5.2971 -0.8159 -1.3648 C.2 1 UNL1111111111 0.5835 21 C -5.3408 -2.0243 0.5690 C.2 1 UNL1111111111 0.1473 22 C -5.4859 -3.1316 1.2857 C.2 1 UNL1111111111 -0.3732 23 H 2.5526 2.3302 0.6056 H 1 UNL1111111111 0.1357 24 H 2.3435 1.8335 -1.0754 H 1 UNL1111111111 0.1367 25 H 3.2062 -0.0471 1.2245 H 1 UNL1111111111 0.1367 26 H 3.0012 -0.5396 -0.4589 H 1 UNL1111111111 0.1377 27 H 0.7892 0.6511 1.3223 H 1 UNL1111111111 0.1370 28 H 0.5822 0.1522 -0.3601 H 1 UNL1111111111 0.1380 29 H 4.9763 1.6307 0.5198 H 1 UNL1111111111 0.1360 30 H 4.7694 1.1437 -1.1647 H 1 UNL1111111111 0.1367 31 H -0.0856 2.5335 -0.9720 H 1 UNL1111111111 0.1385 32 H 0.0975 3.0093 0.7183 H 1 UNL1111111111 0.1365 33 H 5.4259 -1.2325 -0.5616 H 1 UNL1111111111 0.1371 34 H 5.6265 -0.7512 1.1254 H 1 UNL1111111111 0.1364 35 H -1.6338 1.2368 1.3745 H 1 UNL1111111111 0.1450 36 H -1.8424 0.8427 -0.3357 H 1 UNL1111111111 0.1376 37 H 7.1956 0.4579 -1.2505 H 1 UNL1111111111 0.1365 38 H 7.3996 0.9288 0.4389 H 1 UNL1111111111 0.1360 39 H -2.5451 3.2494 -0.7935 H 1 UNL1111111111 0.1405 40 H -2.3322 3.6288 0.9164 H 1 UNL1111111111 0.1406 41 H 7.8515 -1.9238 -0.6696 H 1 UNL1111111111 0.1368 42 H 8.0464 -1.4608 1.0223 H 1 UNL1111111111 0.1365 43 H -4.7135 3.1700 0.5944 H 1 UNL1111111111 0.1591 44 H -4.0309 1.8346 1.5330 H 1 UNL1111111111 0.1753 45 H 9.8204 0.2314 0.3533 H 1 UNL1111111111 0.1333 46 H 9.6267 -0.2371 -1.3382 H 1 UNL1111111111 0.1336 47 H -4.4562 1.7776 -1.5593 H 1 UNL1111111111 0.1638 48 H 10.3199 -2.6102 -0.7600 H 1 UNL1111111111 0.1425 49 H 10.5163 -2.1391 0.9321 H 1 UNL1111111111 0.1423 50 H 11.5700 -1.4469 -0.3061 H 1 UNL1111111111 0.1400 51 H -5.6617 -0.1755 1.7272 H 1 UNL1111111111 0.1710 52 H -3.0017 -0.9688 1.1592 H 1 UNL1111111111 0.3222 53 H -5.7634 -4.0830 0.8557 H 1 UNL1111111111 0.1746 54 H -5.3344 -3.1657 2.3534 H 1 UNL1111111111 0.1719 @BOND 1 1 20 1 2 1 21 1 3 2 19 1 4 2 52 1 5 3 20 2 6 4 5 1 7 4 6 1 8 4 23 1 9 4 24 1 10 5 7 1 11 5 25 1 12 5 26 1 13 6 8 1 14 6 27 1 15 6 28 1 16 7 9 1 17 7 29 1 18 7 30 1 19 8 10 1 20 8 31 1 21 8 32 1 22 9 11 1 23 9 33 1 24 9 34 1 25 10 12 1 26 10 35 1 27 10 36 1 28 11 13 1 29 11 37 1 30 11 38 1 31 12 14 1 32 12 39 1 33 12 40 1 34 13 15 1 35 13 41 1 36 13 42 1 37 14 16 1 38 14 43 1 39 14 44 1 40 15 18 1 41 15 45 1 42 15 46 1 43 16 17 2 44 16 47 1 45 17 19 1 46 17 20 1 47 18 48 1 48 18 49 1 49 18 50 1 50 19 21 1 51 19 51 1 52 21 22 2 53 22 53 1 54 22 54 1