@MOLECULE (E,5R)-3,5-dimethyloct-3-ene 30 29 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.6996 0.8636 -0.0916 C.3 1 UNL11111111 -0.0817 2 H -0.6954 0.8673 -1.2089 H 1 UNL11111111 0.1365 3 C -1.2477 2.2138 0.3919 C.3 1 UNL11111111 -0.4468 4 C -1.5734 -0.3107 0.3981 C.3 1 UNL11111111 -0.2809 5 C -2.9036 -0.3861 -0.3604 C.3 1 UNL11111111 -0.2482 6 C -3.7405 -1.5657 0.1360 C.3 1 UNL11111111 -0.4397 7 C 0.6881 0.6691 0.4419 C.2 1 UNL11111111 -0.2412 8 C 1.7278 0.2271 -0.2763 C.2 1 UNL11111111 0.0292 9 C 1.6445 -0.1175 -1.7266 C.3 1 UNL11111111 -0.4537 10 C 3.0764 0.0443 0.3609 C.3 1 UNL11111111 -0.2704 11 C 3.2795 -1.4248 0.7431 C.3 1 UNL11111111 -0.4263 12 H -1.3457 2.2417 1.4820 H 1 UNL11111111 0.1440 13 H -0.5812 3.0324 0.0979 H 1 UNL11111111 0.1446 14 H -2.2347 2.4181 -0.0348 H 1 UNL11111111 0.1412 15 H -1.0174 -1.2593 0.2691 H 1 UNL11111111 0.1399 16 H -1.7562 -0.2167 1.4836 H 1 UNL11111111 0.1397 17 H -3.4676 0.5572 -0.2332 H 1 UNL11111111 0.1344 18 H -2.7169 -0.4841 -1.4461 H 1 UNL11111111 0.1315 19 H -3.2223 -2.5182 -0.0215 H 1 UNL11111111 0.1423 20 H -3.9547 -1.4805 1.2072 H 1 UNL11111111 0.1421 21 H -4.7001 -1.6210 -0.3891 H 1 UNL11111111 0.1387 22 H 0.7962 0.9059 1.4986 H 1 UNL11111111 0.1482 23 H 1.5318 0.7887 -2.3394 H 1 UNL11111111 0.1560 24 H 2.5379 -0.6442 -2.0860 H 1 UNL11111111 0.1512 25 H 0.7838 -0.7672 -1.9407 H 1 UNL11111111 0.1560 26 H 3.8787 0.3761 -0.3276 H 1 UNL11111111 0.1422 27 H 3.1816 0.6839 1.2602 H 1 UNL11111111 0.1416 28 H 2.5065 -1.7598 1.4453 H 1 UNL11111111 0.1472 29 H 3.2261 -2.0774 -0.1356 H 1 UNL11111111 0.1437 30 H 4.2532 -1.5809 1.2180 H 1 UNL11111111 0.1387 @BOND 1 1 2 1 2 1 3 1 3 1 4 1 4 4 5 1 5 5 6 1 6 1 7 1 7 7 8 2 8 8 9 1 9 8 10 1 10 10 11 1 11 3 12 1 12 3 13 1 13 3 14 1 14 4 15 1 15 4 16 1 16 5 17 1 17 5 18 1 18 6 19 1 19 6 20 1 20 6 21 1 21 7 22 1 22 9 23 1 23 9 24 1 24 9 25 1 25 10 26 1 26 10 27 1 27 11 28 1 28 11 29 1 29 11 30 1