@MOLECULE 2-methyl-n-(2-pentanyl)propanamide 30 29 0 0 0 SMALL USER_CHARGES @ATOM 1 C -2.3243 0.5340 0.5855 C.3 1 UNL11111111 -0.1500 2 C -2.9372 1.7423 -0.1217 C.3 1 UNL11111111 -0.4347 3 C -3.3355 -0.6080 0.7105 C.3 1 UNL11111111 -0.4423 4 C -1.1581 0.0232 -0.2564 C.2 1 UNL11111111 0.5763 5 O -1.1713 0.0031 -1.4701 O.2 1 UNL11111111 -0.5405 6 N -0.0619 -0.4383 0.4470 N.am 1 UNL11111111 -0.6320 7 C 1.0897 -1.0228 -0.2578 C.3 1 UNL11111111 0.1159 8 H 0.9836 -0.8034 -1.3573 H 1 UNL11111111 0.1706 9 C 1.0986 -2.5464 -0.0424 C.3 1 UNL11111111 -0.4839 10 C 2.4025 -0.4043 0.2686 C.3 1 UNL11111111 -0.3116 11 C 2.5383 1.0626 -0.1563 C.3 1 UNL11111111 -0.2441 12 C 3.8663 1.6471 0.3241 C.3 1 UNL11111111 -0.4402 13 H -1.9792 0.8409 1.6011 H 1 UNL11111111 0.1420 14 H -3.8281 2.1050 0.4004 H 1 UNL11111111 0.1443 15 H -2.2239 2.5720 -0.1929 H 1 UNL11111111 0.1487 16 H -3.2309 1.4882 -1.1519 H 1 UNL11111111 0.1699 17 H -2.9141 -1.4703 1.2382 H 1 UNL11111111 0.1436 18 H -4.2307 -0.2872 1.2559 H 1 UNL11111111 0.1512 19 H -3.6640 -0.9562 -0.2797 H 1 UNL11111111 0.1639 20 H -0.0379 -0.4551 1.4493 H 1 UNL11111111 0.3047 21 H 1.8926 -3.0207 -0.6283 H 1 UNL11111111 0.1524 22 H 1.2503 -2.8117 1.0076 H 1 UNL11111111 0.1450 23 H 0.1466 -2.9885 -0.3631 H 1 UNL11111111 0.1596 24 H 2.4576 -0.4896 1.3684 H 1 UNL11111111 0.1383 25 H 3.2589 -0.9875 -0.1203 H 1 UNL11111111 0.1469 26 H 2.4610 1.1489 -1.2577 H 1 UNL11111111 0.1418 27 H 1.6927 1.6530 0.2461 H 1 UNL11111111 0.1407 28 H 3.9461 2.7101 0.0693 H 1 UNL11111111 0.1422 29 H 3.9742 1.5614 1.4109 H 1 UNL11111111 0.1397 30 H 4.7198 1.1346 -0.1338 H 1 UNL11111111 0.1416 @BOND 1 1 2 1 2 1 3 1 3 1 4 1 4 4 5 2 5 4 6 am 6 6 7 1 7 7 8 1 8 7 9 1 9 7 10 1 10 10 11 1 11 11 12 1 12 1 13 1 13 2 14 1 14 2 15 1 15 2 16 1 16 3 17 1 17 3 18 1 18 3 19 1 19 6 20 1 20 9 21 1 21 9 22 1 22 9 23 1 23 10 24 1 24 10 25 1 25 11 26 1 26 11 27 1 27 12 28 1 28 12 29 1 29 12 30 1