@MOLECULE 5-methyl-N-propyl-hexanamide 33 32 0 0 0 SMALL USER_CHARGES @ATOM 1 C -4.0632 0.1188 -0.2362 C.3 1 UNL11111111 -0.0555 2 C -5.2866 -0.8077 -0.2493 C.3 1 UNL11111111 -0.4607 3 C -4.2694 1.2359 0.7930 C.3 1 UNL11111111 -0.4545 4 C -2.7956 -0.6983 0.0828 C.3 1 UNL11111111 -0.2902 5 C -1.5250 0.1052 -0.2102 C.3 1 UNL11111111 -0.2470 6 C -0.2726 -0.7367 0.0582 C.3 1 UNL11111111 -0.3648 7 C 0.9632 0.1078 -0.1605 C.2 1 UNL11111111 0.5874 8 O 0.9485 1.2480 -0.5770 O.2 1 UNL11111111 -0.5371 9 N 2.1651 -0.5028 0.1442 N.am 1 UNL11111111 -0.6309 10 C 3.4098 0.2618 -0.0315 C.3 1 UNL11111111 -0.0546 11 C 4.6322 -0.6216 0.2593 C.3 1 UNL11111111 -0.2821 12 C 5.9115 0.1942 0.0861 C.3 1 UNL11111111 -0.4338 13 H -3.9512 0.5771 -1.2487 H 1 UNL11111111 0.1322 14 H -6.2031 -0.2499 -0.4698 H 1 UNL11111111 0.1437 15 H -5.1886 -1.5901 -1.0085 H 1 UNL11111111 0.1403 16 H -5.4271 -1.2987 0.7193 H 1 UNL11111111 0.1430 17 H -3.4238 1.9335 0.7999 H 1 UNL11111111 0.1484 18 H -5.1719 1.8156 0.5733 H 1 UNL11111111 0.1408 19 H -4.3735 0.8345 1.8061 H 1 UNL11111111 0.1421 20 H -2.8126 -1.0169 1.1409 H 1 UNL11111111 0.1369 21 H -2.7961 -1.6292 -0.5146 H 1 UNL11111111 0.1348 22 H -1.5204 0.4633 -1.2591 H 1 UNL11111111 0.1542 23 H -1.4954 1.0274 0.4047 H 1 UNL11111111 0.1556 24 H -0.2929 -1.1319 1.0926 H 1 UNL11111111 0.1605 25 H -0.2535 -1.6176 -0.6138 H 1 UNL11111111 0.1630 26 H 2.2285 -1.4345 0.5018 H 1 UNL11111111 0.3066 27 H 3.4473 0.6643 -1.0714 H 1 UNL11111111 0.1525 28 H 3.3922 1.1502 0.6421 H 1 UNL11111111 0.1463 29 H 4.5784 -1.0278 1.2874 H 1 UNL11111111 0.1395 30 H 4.6444 -1.4963 -0.4188 H 1 UNL11111111 0.1418 31 H 6.8000 -0.4102 0.3027 H 1 UNL11111111 0.1448 32 H 6.0147 0.5707 -0.9389 H 1 UNL11111111 0.1486 33 H 5.9332 1.0596 0.7596 H 1 UNL11111111 0.1480 @BOND 1 1 2 1 2 1 3 1 3 1 4 1 4 4 5 1 5 5 6 1 6 6 7 1 7 7 8 2 8 7 9 am 9 9 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 4 20 1 20 4 21 1 21 5 22 1 22 5 23 1 23 6 24 1 24 6 25 1 25 9 26 1 26 10 27 1 27 10 28 1 28 11 29 1 29 11 30 1 30 12 31 1 31 12 32 1 32 12 33 1