@MOLECULE (e)-4-methyl-2-hexene 21 20 0 0 0 SMALL USER_CHARGES @ATOM 1 C 0.5402 -0.2980 0.2283 C.3 1 UNL11111111 -0.0900 2 C 1.4532 0.7340 -0.4677 C.3 1 UNL11111111 -0.2598 3 C 1.0261 -1.7329 -0.0181 C.3 1 UNL11111111 -0.4450 4 C -0.8519 -0.1518 -0.3152 C.2 1 UNL11111111 -0.1904 5 C 2.7973 0.8739 0.2446 C.3 1 UNL11111111 -0.4363 6 C -1.8883 0.2215 0.4399 C.2 1 UNL11111111 -0.1435 7 C -3.2708 0.3707 -0.0943 C.3 1 UNL11111111 -0.4438 8 H -0.9540 -0.3738 -1.3743 H 1 UNL11111111 0.1452 9 H -1.7812 0.4417 1.5007 H 1 UNL11111111 0.1406 10 H 0.5521 -0.1007 1.3282 H 1 UNL11111111 0.1370 11 H 1.6085 0.4496 -1.5244 H 1 UNL11111111 0.1365 12 H 0.9405 1.7156 -0.4919 H 1 UNL11111111 0.1378 13 H 0.3301 -2.4614 0.4130 H 1 UNL11111111 0.1447 14 H 1.1124 -1.9514 -1.0875 H 1 UNL11111111 0.1440 15 H 2.0080 -1.9019 0.4357 H 1 UNL11111111 0.1437 16 H 3.3716 -0.0584 0.2037 H 1 UNL11111111 0.1427 17 H 3.4090 1.6571 -0.2166 H 1 UNL11111111 0.1397 18 H 2.6676 1.1363 1.3003 H 1 UNL11111111 0.1419 19 H -3.9704 -0.2991 0.4265 H 1 UNL11111111 0.1528 20 H -3.6390 1.3979 0.0434 H 1 UNL11111111 0.1530 21 H -3.3422 0.1421 -1.1657 H 1 UNL11111111 0.1492 @BOND 1 11 2 1 2 8 4 1 3 21 7 1 4 14 3 1 5 12 2 1 6 2 1 1 7 2 5 1 8 4 1 1 9 4 6 2 10 17 5 1 11 7 20 1 12 7 19 1 13 7 6 1 14 3 1 1 15 3 13 1 16 3 15 1 17 16 5 1 18 1 10 1 19 5 18 1 20 6 9 1