@MOLECULE (2S)-N-(1,1-dimethylpropyl)-2-methyl-butanamide 33 32 0 0 0 SMALL USER_CHARGES @ATOM 1 C 4.3869 -0.1182 -0.9215 C.3 1 UNL11111111 -0.4381 2 C 3.1254 -0.6029 -0.2116 C.3 1 UNL11111111 -0.2438 3 C 2.0295 0.4757 -0.1975 C.3 1 UNL11111111 -0.1763 4 H 1.9491 0.9213 -1.2166 H 1 UNL11111111 0.1468 5 C 2.3223 1.5735 0.8261 C.3 1 UNL11111111 -0.4395 6 C 0.7111 -0.1897 0.1987 C.2 1 UNL11111111 0.5845 7 O 0.6635 -1.1826 0.8952 O.2 1 UNL11111111 -0.5483 8 N -0.4277 0.4154 -0.2962 N.am 1 UNL11111111 -0.6583 9 C -1.7959 -0.0953 -0.0148 C.3 1 UNL11111111 0.3234 10 C -1.9220 -1.5228 -0.5692 C.3 1 UNL11111111 -0.4873 11 C -2.0442 -0.0819 1.5013 C.3 1 UNL11111111 -0.4896 12 C -2.7761 0.8690 -0.7446 C.3 1 UNL11111111 -0.3067 13 C -4.2429 0.5006 -0.5391 C.3 1 UNL11111111 -0.4267 14 H 4.8044 0.7738 -0.4417 H 1 UNL11111111 0.1415 15 H 5.1650 -0.8905 -0.9076 H 1 UNL11111111 0.1432 16 H 4.1908 0.1297 -1.9703 H 1 UNL11111111 0.1396 17 H 2.7422 -1.5201 -0.7041 H 1 UNL11111111 0.1487 18 H 3.3556 -0.9159 0.8266 H 1 UNL11111111 0.1556 19 H 3.2784 2.0664 0.6150 H 1 UNL11111111 0.1518 20 H 1.5448 2.3450 0.8319 H 1 UNL11111111 0.1422 21 H 2.3859 1.1625 1.8431 H 1 UNL11111111 0.1604 22 H -0.3574 1.2518 -0.8497 H 1 UNL11111111 0.3042 23 H -1.1838 -2.1907 -0.0977 H 1 UNL11111111 0.1816 24 H -2.9110 -1.9428 -0.3674 H 1 UNL11111111 0.1491 25 H -1.7482 -1.5548 -1.6484 H 1 UNL11111111 0.1479 26 H -1.9653 0.9269 1.9150 H 1 UNL11111111 0.1469 27 H -3.0330 -0.4786 1.7473 H 1 UNL11111111 0.1500 28 H -1.3050 -0.7101 2.0231 H 1 UNL11111111 0.1823 29 H -2.6065 1.9030 -0.3871 H 1 UNL11111111 0.1390 30 H -2.5479 0.8702 -1.8283 H 1 UNL11111111 0.1405 31 H -4.4626 -0.5116 -0.8981 H 1 UNL11111111 0.1474 32 H -4.5300 0.5479 0.5178 H 1 UNL11111111 0.1473 33 H -4.8988 1.1889 -1.0855 H 1 UNL11111111 0.1408 @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 9 11 1 11 9 12 1 12 12 13 1 13 1 14 1 14 1 15 1 15 1 16 1 16 2 17 1 17 2 18 1 18 5 19 1 19 5 20 1 20 5 21 1 21 8 22 1 22 10 23 1 23 10 24 1 24 10 25 1 25 11 26 1 26 11 27 1 27 11 28 1 28 12 29 1 29 12 30 1 30 13 31 1 31 13 32 1 32 13 33 1