@MOLECULE methyl l-valinate 22 21 0 0 0 SMALL GASTEIGER @ATOM 1 N -0.7969 1.9219 0.3903 N.3 1 UNL1111111111 -0.6342 2 C -0.5267 0.4774 0.4447 C.3 1 UNL1111111111 -0.0325 3 C 0.8572 0.3023 -0.1709 C.2 1 UNL1111111111 0.5910 4 O 1.2141 0.6548 -1.2632 O.2 1 UNL1111111111 -0.5050 5 C -1.5196 -0.4177 -0.3486 C.3 1 UNL1111111111 -0.1128 6 C -1.1386 -1.8885 -0.1673 C.3 1 UNL1111111111 -0.4560 7 C -2.9507 -0.1828 0.1388 C.3 1 UNL1111111111 -0.4507 8 O 1.6615 -0.3552 0.6985 O.3 1 UNL1111111111 -0.4062 9 C 3.0101 -0.5473 0.2828 C.3 1 UNL1111111111 -0.1727 10 H -0.7820 2.2797 -0.5543 H 1 UNL1111111111 0.2654 11 H -1.6727 2.1579 0.8275 H 1 UNL1111111111 0.2597 12 H -0.5158 0.1683 1.5249 H 1 UNL1111111111 0.1760 13 H -1.4543 -0.1527 -1.4331 H 1 UNL1111111111 0.1511 14 H -0.1208 -2.0933 -0.5219 H 1 UNL1111111111 0.1522 15 H -1.1849 -2.1941 0.8847 H 1 UNL1111111111 0.1513 16 H -1.8129 -2.5455 -0.7293 H 1 UNL1111111111 0.1523 17 H -3.3076 0.8237 -0.1018 H 1 UNL1111111111 0.1405 18 H -3.6456 -0.8877 -0.3357 H 1 UNL1111111111 0.1536 19 H -3.0398 -0.3243 1.2219 H 1 UNL1111111111 0.1491 20 H 3.0505 -1.0124 -0.7079 H 1 UNL1111111111 0.1416 21 H 3.5285 0.4176 0.2731 H 1 UNL1111111111 0.1413 22 H 3.4160 -1.2108 1.0542 H 1 UNL1111111111 0.1448 @BOND 1 1 2 1 2 1 10 1 3 1 11 1 4 2 3 1 5 2 5 1 6 2 12 1 7 3 4 2 8 3 8 1 9 5 6 1 10 5 7 1 11 5 13 1 12 6 14 1 13 6 15 1 14 6 16 1 15 7 17 1 16 7 18 1 17 7 19 1 18 8 9 1 19 9 20 1 20 9 21 1 21 9 22 1