@MOLECULE n-isobutyl-3,3-dimethylbutanamide 33 32 0 0 0 SMALL USER_CHARGES @ATOM 1 C -2.9839 0.1282 -1.4573 C.3 1 UNL111111111 -0.4735 2 C -2.8415 -0.1553 0.0426 C.3 1 UNL111111111 0.1646 3 C -3.0778 1.1272 0.8483 C.3 1 UNL111111111 -0.4738 4 C -3.8831 -1.2136 0.4578 C.3 1 UNL111111111 -0.4740 5 C -1.4393 -0.7343 0.3537 C.3 1 UNL111111111 -0.3966 6 C -0.2998 0.1935 0.0032 C.2 1 UNL111111111 0.5992 7 O -0.3946 1.2878 -0.5141 O.2 1 UNL111111111 -0.5440 8 N 0.9557 -0.2963 0.3213 N.am 1 UNL111111111 -0.6328 9 C 2.1362 0.5122 -0.0182 C.3 1 UNL111111111 -0.0703 10 C 3.4388 -0.2231 0.3611 C.3 1 UNL111111111 -0.0907 11 C 3.6690 -1.4378 -0.5434 C.3 1 UNL111111111 -0.4521 12 C 4.6106 0.7559 0.2333 C.3 1 UNL111111111 -0.4524 13 H -2.2755 0.9063 -1.7804 H 1 UNL111111111 0.1760 14 H -2.7909 -0.7621 -2.0611 H 1 UNL111111111 0.1387 15 H -3.9884 0.4879 -1.7003 H 1 UNL111111111 0.1442 16 H -4.0774 1.5332 0.6652 H 1 UNL111111111 0.1449 17 H -2.9753 0.9590 1.9235 H 1 UNL111111111 0.1387 18 H -2.3556 1.9075 0.5646 H 1 UNL111111111 0.1746 19 H -3.7524 -2.1470 -0.0974 H 1 UNL111111111 0.1415 20 H -3.8202 -1.4434 1.5253 H 1 UNL111111111 0.1414 21 H -4.8997 -0.8569 0.2604 H 1 UNL111111111 0.1487 22 H -1.3890 -0.9906 1.4316 H 1 UNL111111111 0.1635 23 H -1.3153 -1.6874 -0.1997 H 1 UNL111111111 0.1635 24 H 1.1047 -1.1968 0.7308 H 1 UNL111111111 0.3066 25 H 2.1190 0.7536 -1.1062 H 1 UNL111111111 0.1506 26 H 2.0666 1.4899 0.5149 H 1 UNL111111111 0.1486 27 H 3.3698 -0.5647 1.4223 H 1 UNL111111111 0.1344 28 H 2.8475 -2.1581 -0.4798 H 1 UNL111111111 0.1400 29 H 3.7592 -1.1420 -1.5955 H 1 UNL111111111 0.1513 30 H 4.5905 -1.9650 -0.2722 H 1 UNL111111111 0.1447 31 H 4.4871 1.6216 0.8938 H 1 UNL111111111 0.1471 32 H 5.5591 0.2753 0.4983 H 1 UNL111111111 0.1472 33 H 4.7113 1.1330 -0.7911 H 1 UNL111111111 0.1502 @BOND 1 1 2 1 2 2 3 1 3 2 4 1 4 2 5 1 5 5 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 3 16 1 16 3 17 1 17 3 18 1 18 4 19 1 19 4 20 1 20 4 21 1 21 5 22 1 22 5 23 1 23 8 24 1 24 9 25 1 25 9 26 1 26 10 27 1 27 11 28 1 28 11 29 1 29 11 30 1 30 12 31 1 31 12 32 1 32 12 33 1