@MOLECULE 3-ethyl-4-methyl-1-pentene 24 23 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.2082 0.0143 0.2949 C.3 1 UNL111111111 -0.1399 2 C 1.2834 0.4258 0.1662 C.3 1 UNL111111111 -0.0696 3 C -0.5105 -1.3508 -0.3503 C.3 1 UNL111111111 -0.2553 4 C 2.1559 -0.4262 1.0964 C.3 1 UNL111111111 -0.4555 5 C 1.8029 0.3324 -1.2716 C.3 1 UNL111111111 -0.4523 6 C -1.0597 1.0832 -0.3294 C.2 1 UNL111111111 -0.1089 7 C -1.9110 -1.8376 0.0233 C.3 1 UNL111111111 -0.4411 8 C -1.7042 2.0060 0.3841 C.2 1 UNL111111111 -0.3527 9 H -0.4409 -0.0629 1.3876 H 1 UNL111111111 0.1441 10 H 1.3601 1.4933 0.4967 H 1 UNL111111111 0.1346 11 H -0.4150 -1.2860 -1.4500 H 1 UNL111111111 0.1367 12 H 0.2433 -2.0921 -0.0237 H 1 UNL111111111 0.1370 13 H 2.1578 -1.4796 0.7969 H 1 UNL111111111 0.1452 14 H 3.1955 -0.0809 1.0854 H 1 UNL111111111 0.1443 15 H 1.8038 -0.3784 2.1322 H 1 UNL111111111 0.1422 16 H 1.1918 0.9291 -1.9570 H 1 UNL111111111 0.1436 17 H 2.8319 0.7030 -1.3411 H 1 UNL111111111 0.1433 18 H 1.8037 -0.6996 -1.6377 H 1 UNL111111111 0.1451 19 H -1.1099 1.0553 -1.4167 H 1 UNL111111111 0.1399 20 H -2.6775 -1.1155 -0.2832 H 1 UNL111111111 0.1479 21 H -2.1418 -2.7925 -0.4602 H 1 UNL111111111 0.1402 22 H -2.0115 -1.9802 1.1048 H 1 UNL111111111 0.1423 23 H -2.3105 2.7810 -0.0563 H 1 UNL111111111 0.1444 24 H -1.6776 2.0609 1.4604 H 1 UNL111111111 0.1445 @BOND 1 16 5 1 2 18 5 1 3 11 3 1 4 19 6 1 5 17 5 1 6 5 2 1 7 21 7 1 8 3 12 1 9 3 7 1 10 3 1 1 11 6 1 1 12 6 8 2 13 20 7 1 14 23 8 1 15 7 22 1 16 2 1 1 17 2 10 1 18 2 4 1 19 1 9 1 20 8 24 1 21 13 4 1 22 14 4 1 23 4 15 1