@MOLECULE (E,7R)-4,4,7-trimethyldec-5-ene 39 38 0 0 0 SMALL USER_CHARGES @ATOM 1 C -4.4934 2.2072 -0.2619 C.3 1 UNL11111111 -0.8701 2 C -3.9299 0.8420 0.1353 C.3 1 UNL11111111 -0.0157 3 C -2.4551 0.7321 -0.2689 C.3 1 UNL11111111 -0.6538 4 C -1.8249 -0.6496 0.0382 C.3 1 UNL11111111 0.6738 5 C -1.8844 -0.9435 1.5438 C.3 1 UNL11111111 -0.8814 6 C -2.5568 -1.7740 -0.7195 C.3 1 UNL11111111 -0.9219 7 C -0.4108 -0.6016 -0.4872 C.2 1 UNL11111111 -0.4417 8 C 0.6947 -0.6353 0.2586 C.2 1 UNL11111111 -0.2443 9 C 2.0728 -0.6093 -0.3387 C.3 1 UNL11111111 0.0942 10 H 2.0195 -0.4046 -1.4362 H 1 UNL11111111 0.1517 11 C 2.7192 -1.9858 -0.1266 C.3 1 UNL11111111 -0.8797 12 C 2.8914 0.5115 0.3327 C.3 1 UNL11111111 -0.5237 13 C 4.1956 0.7923 -0.4242 C.3 1 UNL11111111 -0.0866 14 C 4.9755 1.9271 0.2407 C.3 1 UNL11111111 -0.8306 15 H -3.9466 3.0228 0.2241 H 1 UNL11111111 0.2536 16 H -4.4303 2.3663 -1.3440 H 1 UNL11111111 0.2537 17 H -5.5464 2.2995 0.0244 H 1 UNL11111111 0.2282 18 H -4.0405 0.6920 1.2253 H 1 UNL11111111 0.1219 19 H -4.5191 0.0387 -0.3452 H 1 UNL11111111 0.1205 20 H -2.3539 0.9472 -1.3495 H 1 UNL11111111 0.2151 21 H -1.8699 1.5157 0.2493 H 1 UNL11111111 0.2190 22 H -2.9172 -1.0750 1.8832 H 1 UNL11111111 0.2240 23 H -1.3427 -1.8639 1.7886 H 1 UNL11111111 0.2435 24 H -1.4484 -0.1270 2.1291 H 1 UNL11111111 0.2390 25 H -2.6549 -1.5424 -1.7845 H 1 UNL11111111 0.2470 26 H -2.0125 -2.7208 -0.6317 H 1 UNL11111111 0.2540 27 H -3.5630 -1.9363 -0.3219 H 1 UNL11111111 0.2382 28 H -0.3554 -0.5351 -1.5742 H 1 UNL11111111 0.2174 29 H 0.6745 -0.6984 1.3437 H 1 UNL11111111 0.1985 30 H 2.8257 -2.2199 0.9379 H 1 UNL11111111 0.2648 31 H 2.1113 -2.7772 -0.5798 H 1 UNL11111111 0.2562 32 H 3.7157 -2.0315 -0.5776 H 1 UNL11111111 0.2345 33 H 2.2825 1.4349 0.3774 H 1 UNL11111111 0.1976 34 H 3.1114 0.2440 1.3820 H 1 UNL11111111 0.2259 35 H 4.8177 -0.1217 -0.4603 H 1 UNL11111111 0.1433 36 H 3.9753 1.0511 -1.4768 H 1 UNL11111111 0.1239 37 H 4.3978 2.8580 0.2497 H 1 UNL11111111 0.2472 38 H 5.2267 1.6850 1.2793 H 1 UNL11111111 0.2381 39 H 5.9142 2.1270 -0.2872 H 1 UNL11111111 0.2247 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 4 5 1 5 4 6 1 6 4 7 1 7 7 8 2 8 8 9 1 9 9 10 1 10 9 11 1 11 9 12 1 12 12 13 1 13 13 14 1 14 1 15 1 15 1 16 1 16 1 17 1 17 2 18 1 18 2 19 1 19 3 20 1 20 3 21 1 21 5 22 1 22 5 23 1 23 5 24 1 24 6 25 1 25 6 26 1 26 6 27 1 27 7 28 1 28 8 29 1 29 11 30 1 30 11 31 1 31 11 32 1 32 12 33 1 33 12 34 1 34 13 35 1 35 13 36 1 36 14 37 1 37 14 38 1 38 14 39 1