@MOLECULE 4-methylpentene 18 17 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 C -0.9672 -0.0074 0.3482 C.3 1 UNL1 -0.0516 2 C 0.2819 0.7218 -0.1887 C.3 1 UNL1 -0.3085 3 C -0.9740 -1.4685 -0.1145 C.3 1 UNL1 -0.4543 4 C -2.2338 0.7063 -0.1404 C.3 1 UNL1 -0.4581 5 C 1.5337 0.1939 0.4351 C.2 1 UNL1 -0.0981 6 C 2.6363 -0.0820 -0.2612 C.2 1 UNL1 -0.3518 7 H -0.9491 0.0182 1.4643 H 1 UNL1 0.1288 8 H 0.3136 0.6413 -1.2930 H 1 UNL1 0.1496 9 H 0.2012 1.8088 0.0242 H 1 UNL1 0.1501 10 H -1.8328 -2.0117 0.2926 H 1 UNL1 0.1415 11 H -1.0209 -1.5442 -1.2060 H 1 UNL1 0.1452 12 H -0.0652 -1.9895 0.2092 H 1 UNL1 0.1477 13 H -3.1359 0.2093 0.2330 H 1 UNL1 0.1449 14 H -2.2661 1.7460 0.2014 H 1 UNL1 0.1417 15 H -2.2935 0.7145 -1.2340 H 1 UNL1 0.1456 16 H 1.4862 0.0570 1.5154 H 1 UNL1 0.1383 17 H 3.5452 -0.4503 0.1863 H 1 UNL1 0.1441 18 H 2.7182 0.0361 -1.3294 H 1 UNL1 0.1448 @BOND 1 18 6 1 2 8 2 1 3 15 4 1 4 11 3 1 5 6 17 1 6 6 5 2 7 2 9 1 8 2 1 1 9 2 5 1 10 4 14 1 11 4 13 1 12 4 1 1 13 3 12 1 14 3 10 1 15 3 1 1 16 1 7 1 17 5 16 1