@MOLECULE n-isobutyl-2-methylbutanamide 30 29 0 0 0 SMALL USER_CHARGES @ATOM 1 C 4.2834 0.4655 0.5826 C.3 1 UNL11111111 -0.4364 2 C 2.9916 0.6198 -0.2158 C.3 1 UNL11111111 -0.2470 3 C 1.8550 -0.2386 0.3660 C.3 1 UNL11111111 -0.1706 4 H 1.8165 -0.0916 1.4701 H 1 UNL11111111 0.1434 5 C 2.0371 -1.7251 0.0557 C.3 1 UNL11111111 -0.4384 6 C 0.5571 0.2059 -0.3008 C.2 1 UNL11111111 0.5707 7 O 0.4261 0.2836 -1.5052 O.2 1 UNL11111111 -0.5396 8 N -0.4752 0.5528 0.5500 N.am 1 UNL11111111 -0.6138 9 C -1.7911 0.9138 0.0129 C.3 1 UNL11111111 -0.0843 10 C -2.8898 -0.0573 0.5096 C.3 1 UNL11111111 -0.0903 11 C -4.2598 0.5195 0.1396 C.3 1 UNL11111111 -0.4550 12 C -2.7083 -1.4430 -0.1139 C.3 1 UNL11111111 -0.4494 13 H 5.0732 1.1102 0.1791 H 1 UNL11111111 0.1436 14 H 4.1443 0.7372 1.6345 H 1 UNL11111111 0.1399 15 H 4.6568 -0.5642 0.5524 H 1 UNL11111111 0.1436 16 H 2.6852 1.6849 -0.2329 H 1 UNL11111111 0.1424 17 H 3.1553 0.3483 -1.2788 H 1 UNL11111111 0.1586 18 H 2.0275 -1.9064 -1.0295 H 1 UNL11111111 0.1663 19 H 2.9929 -2.0972 0.4414 H 1 UNL11111111 0.1512 20 H 1.2394 -2.3329 0.4960 H 1 UNL11111111 0.1424 21 H -0.4105 0.4301 1.5435 H 1 UNL11111111 0.3035 22 H -2.0278 1.9559 0.3247 H 1 UNL11111111 0.1338 23 H -1.7551 0.9144 -1.1035 H 1 UNL11111111 0.1755 24 H -2.8223 -0.1475 1.6198 H 1 UNL11111111 0.1274 25 H -4.3595 0.6561 -0.9437 H 1 UNL11111111 0.1509 26 H -5.0681 -0.1490 0.4574 H 1 UNL11111111 0.1476 27 H -4.4326 1.4910 0.6147 H 1 UNL11111111 0.1420 28 H -3.4433 -2.1561 0.2719 H 1 UNL11111111 0.1415 29 H -2.8177 -1.4103 -1.2049 H 1 UNL11111111 0.1536 30 H -1.7101 -1.8461 0.0928 H 1 UNL11111111 0.1470 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 3 5 1 5 3 6 1 6 6 7 2 7 6 8 am 8 8 9 1 9 9 10 1 10 10 11 1 11 10 12 1 12 1 13 1 13 1 14 1 14 1 15 1 15 2 16 1 16 2 17 1 17 5 18 1 18 5 19 1 19 5 20 1 20 8 21 1 21 9 22 1 22 9 23 1 23 10 24 1 24 11 25 1 25 11 26 1 26 11 27 1 27 12 28 1 28 12 29 1 29 12 30 1