@MOLECULE 3-(11-dodecen-1-ylidene)-5-(hydroxymethyl)dihydro-2(3h)-furanone 48 48 0 0 0 SMALL GASTEIGER @ATOM 1 O 6.1938 0.0849 -0.3205 O.3 1 UNL1111111111 -0.4188 2 O 6.8858 2.8735 -0.2790 O.3 1 UNL1111111111 -0.5322 3 O 5.6047 -1.7774 -1.3837 O.2 1 UNL1111111111 -0.4331 4 C -1.9213 -0.7117 -0.2004 C.3 1 UNL1111111111 -0.2726 5 C -3.2166 -0.5377 0.6026 C.3 1 UNL1111111111 -0.2738 6 C -0.7333 -0.9650 0.7368 C.3 1 UNL1111111111 -0.2757 7 C -4.4041 -0.2849 -0.3349 C.3 1 UNL1111111111 -0.2710 8 C 0.5627 -1.1461 -0.0623 C.3 1 UNL1111111111 -0.2601 9 C -5.7007 -0.1158 0.4677 C.3 1 UNL1111111111 -0.2733 10 C 1.7509 -1.3739 0.8862 C.3 1 UNL1111111111 -0.2963 11 C 4.2469 0.4902 1.0257 C.3 1 UNL1111111111 -0.3166 12 C 5.6386 1.0210 0.6158 C.3 1 UNL1111111111 0.0699 13 C 4.0605 -0.7298 0.1867 C.2 1 UNL1111111111 -0.1908 14 C -6.8844 0.1509 -0.4699 C.3 1 UNL1111111111 -0.2646 15 C 3.0055 -1.5434 0.1001 C.2 1 UNL1111111111 -0.0455 16 C 5.2989 -0.9239 -0.6014 C.2 1 UNL1111111111 0.5931 17 C 5.5808 2.3697 -0.1104 C.3 1 UNL1111111111 -0.0387 18 C -8.1865 0.3100 0.3296 C.3 1 UNL1111111111 -0.2900 19 C -9.3308 0.5989 -0.5886 C.2 1 UNL1111111111 -0.1056 20 C -10.1687 1.6200 -0.4125 C.2 1 UNL1111111111 -0.3434 21 H -2.0286 -1.5505 -0.9135 H 1 UNL1111111111 0.1392 22 H -1.7344 0.1879 -0.8160 H 1 UNL1111111111 0.1381 23 H -3.4050 -1.4369 1.2183 H 1 UNL1111111111 0.1370 24 H -3.1119 0.3018 1.3151 H 1 UNL1111111111 0.1365 25 H -0.6290 -0.1226 1.4461 H 1 UNL1111111111 0.1360 26 H -0.9267 -1.8610 1.3564 H 1 UNL1111111111 0.1387 27 H -4.5082 -1.1214 -1.0507 H 1 UNL1111111111 0.1378 28 H -4.2178 0.6175 -0.9470 H 1 UNL1111111111 0.1380 29 H 0.4614 -1.9979 -0.7616 H 1 UNL1111111111 0.1442 30 H 0.7488 -0.2560 -0.6931 H 1 UNL1111111111 0.1434 31 H -5.8923 -1.0214 1.0729 H 1 UNL1111111111 0.1372 32 H -5.5940 0.7154 1.1895 H 1 UNL1111111111 0.1373 33 H 1.5732 -2.2798 1.5061 H 1 UNL1111111111 0.1590 34 H 1.8209 -0.5364 1.6086 H 1 UNL1111111111 0.1494 35 H 3.4477 1.2355 0.8532 H 1 UNL1111111111 0.1646 36 H 4.2111 0.2542 2.1062 H 1 UNL1111111111 0.1653 37 H 6.3674 1.0379 1.4537 H 1 UNL1111111111 0.1582 38 H -6.9844 -0.6732 -1.2007 H 1 UNL1111111111 0.1378 39 H -6.6982 1.0644 -1.0664 H 1 UNL1111111111 0.1415 40 H 3.0192 -2.4029 -0.5811 H 1 UNL1111111111 0.1677 41 H 5.0896 2.2852 -1.0972 H 1 UNL1111111111 0.1338 42 H 5.0798 3.1482 0.4942 H 1 UNL1111111111 0.1473 43 H -8.3965 -0.6170 0.9033 H 1 UNL1111111111 0.1491 44 H -8.0660 1.1065 1.0906 H 1 UNL1111111111 0.1465 45 H -9.4372 -0.0966 -1.4209 H 1 UNL1111111111 0.1392 46 H 7.4311 2.2272 -0.7824 H 1 UNL1111111111 0.3275 47 H -10.9991 1.8274 -1.0685 H 1 UNL1111111111 0.1444 48 H -10.0932 2.3286 0.3966 H 1 UNL1111111111 0.1447 @BOND 1 1 12 1 2 1 16 1 3 2 17 1 4 2 46 1 5 3 16 2 6 4 5 1 7 4 6 1 8 4 21 1 9 4 22 1 10 5 7 1 11 5 23 1 12 5 24 1 13 6 8 1 14 6 25 1 15 6 26 1 16 7 9 1 17 7 27 1 18 7 28 1 19 8 10 1 20 8 29 1 21 8 30 1 22 9 14 1 23 9 31 1 24 9 32 1 25 10 15 1 26 10 33 1 27 10 34 1 28 11 12 1 29 11 13 1 30 11 35 1 31 11 36 1 32 12 17 1 33 12 37 1 34 13 15 2 35 13 16 1 36 14 18 1 37 14 38 1 38 14 39 1 39 15 40 1 40 17 41 1 41 17 42 1 42 18 19 1 43 18 43 1 44 18 44 1 45 19 20 2 46 19 45 1 47 20 47 1 48 20 48 1