@MOLECULE (z,z)-11,13-hexadecadienal 45 44 0 0 0 SMALL USER_CHARGES @ATOM 1 O -6.9835 -0.9123 0.9152 O.2 1 UNL11111111 -0.4349 2 C -0.8498 1.1574 -0.3086 C.3 1 UNL11111111 -0.2702 3 C 0.3184 1.1982 0.6844 C.3 1 UNL11111111 -0.2755 4 C -2.1115 0.6054 0.3665 C.3 1 UNL11111111 -0.2683 5 C 1.5982 1.6873 -0.0048 C.3 1 UNL11111111 -0.2738 6 C -3.2858 0.5674 -0.6196 C.3 1 UNL11111111 -0.2782 7 C 2.8059 1.5274 0.9259 C.3 1 UNL11111111 -0.2637 8 C -4.5414 0.0184 0.0664 C.3 1 UNL11111111 -0.2499 9 C 4.1114 1.9551 0.2341 C.3 1 UNL11111111 -0.2777 10 C -5.7272 -0.0159 -0.9013 C.3 1 UNL11111111 -0.3937 11 C 4.4132 1.0998 -0.9552 C.2 1 UNL11111111 -0.1449 12 C -6.9657 -0.5525 -0.2350 C.2 1 UNL11111111 0.3441 13 C 4.7445 -0.1957 -0.8924 C.2 1 UNL11111111 -0.1724 14 C 4.8626 -0.9492 0.3515 C.2 1 UNL11111111 -0.1727 15 C 4.2085 -2.0893 0.6035 C.2 1 UNL11111111 -0.1479 16 C 3.2476 -2.7400 -0.3396 C.3 1 UNL11111111 -0.2572 17 C 1.8185 -2.2884 -0.0225 C.3 1 UNL11111111 -0.4331 18 H -0.5833 0.5321 -1.1812 H 1 UNL11111111 0.1355 19 H -1.0417 2.1699 -0.7085 H 1 UNL11111111 0.1353 20 H 0.0723 1.8570 1.5376 H 1 UNL11111111 0.1382 21 H 0.4801 0.1925 1.1172 H 1 UNL11111111 0.1377 22 H -2.3734 1.2259 1.2441 H 1 UNL11111111 0.1382 23 H -1.9162 -0.4097 0.7614 H 1 UNL11111111 0.1398 24 H 1.7708 1.1177 -0.9386 H 1 UNL11111111 0.1413 25 H 1.4876 2.7430 -0.3116 H 1 UNL11111111 0.1363 26 H -3.0243 -0.0568 -1.4941 H 1 UNL11111111 0.1355 27 H -3.4792 1.5813 -1.0159 H 1 UNL11111111 0.1344 28 H 2.8922 0.4718 1.2537 H 1 UNL11111111 0.1478 29 H 2.6584 2.1234 1.8453 H 1 UNL11111111 0.1335 30 H -4.7974 0.6308 0.9537 H 1 UNL11111111 0.1505 31 H -4.3515 -0.9979 0.4653 H 1 UNL11111111 0.1508 32 H 4.9473 1.8981 0.9632 H 1 UNL11111111 0.1454 33 H 4.0455 3.0219 -0.0574 H 1 UNL11111111 0.1399 34 H -5.4827 -0.6388 -1.7862 H 1 UNL11111111 0.1641 35 H -5.9277 0.9995 -1.2995 H 1 UNL11111111 0.1639 36 H 4.3366 1.6094 -1.9147 H 1 UNL11111111 0.1394 37 H -7.8743 -0.6086 -0.8492 H 1 UNL11111111 0.1017 38 H 4.9444 -0.7687 -1.8006 H 1 UNL11111111 0.1493 39 H 5.5342 -0.5092 1.0924 H 1 UNL11111111 0.1499 40 H 4.3309 -2.6071 1.5541 H 1 UNL11111111 0.1406 41 H 3.3214 -3.8438 -0.2655 H 1 UNL11111111 0.1394 42 H 3.4907 -2.4963 -1.3939 H 1 UNL11111111 0.1428 43 H 1.0902 -2.7882 -0.6691 H 1 UNL11111111 0.1415 44 H 1.7085 -1.2056 -0.1719 H 1 UNL11111111 0.1540 45 H 1.5498 -2.5055 1.0167 H 1 UNL11111111 0.1436 @BOND 1 36 11 1 2 38 13 1 3 34 10 1 4 26 6 1 5 42 16 1 6 35 10 1 7 18 2 1 8 27 6 1 9 11 13 2 10 11 9 1 11 24 5 1 12 10 12 1 13 10 8 1 14 13 14 1 15 37 12 1 16 19 2 1 17 43 17 1 18 6 8 1 19 6 4 1 20 16 41 1 21 16 17 1 22 16 15 1 23 25 5 1 24 2 4 1 25 2 3 1 26 12 1 2 27 44 17 1 28 33 9 1 29 17 45 1 30 5 3 1 31 5 7 1 32 8 31 1 33 8 30 1 34 9 7 1 35 9 32 1 36 14 15 2 37 14 39 1 38 4 23 1 39 4 22 1 40 15 40 1 41 3 21 1 42 3 20 1 43 7 28 1 44 7 29 1