@MOLECULE 2-methyl-2-propanyl 1-{(2r)-2-[2-(hydroxyamino)-2-oxoethyl]hexanoyl}-l-prolinate 54 54 0 0 0 SMALL GASTEIGER @ATOM 1 O -3.3398 0.4583 0.7277 O.3 1 UNL1111111111 -0.4690 2 O 0.3226 0.2603 1.7196 O.2 1 UNL1111111111 -0.5421 3 O -2.0731 0.0041 -1.0876 O.2 1 UNL1111111111 -0.5273 4 O 4.7663 -1.3975 0.0697 O.2 1 UNL1111111111 -0.4974 5 O 6.4665 0.6215 0.2082 O.3 1 UNL1111111111 -0.2998 6 N -0.0805 1.6675 0.0244 N.am 1 UNL1111111111 -0.5011 7 N 5.1009 0.8114 0.4517 N.am 1 UNL1111111111 -0.4089 8 C -1.4829 1.8444 0.4094 C.3 1 UNL1111111111 0.0252 9 C -1.9374 3.1131 -0.3387 C.3 1 UNL1111111111 -0.2758 10 C 0.1532 2.2260 -1.3192 C.3 1 UNL1111111111 -0.0577 11 C -1.0189 3.2040 -1.5738 C.3 1 UNL1111111111 -0.2788 12 C 2.0039 0.2887 0.0007 C.3 1 UNL1111111111 -0.1669 13 C 0.6907 0.7036 0.6486 C.2 1 UNL1111111111 0.5795 14 C 1.7106 -0.8114 -1.0365 C.3 1 UNL1111111111 -0.2766 15 C -2.3041 0.6506 -0.0991 C.2 1 UNL1111111111 0.5909 16 C 2.9535 -0.1937 1.1070 C.3 1 UNL1111111111 -0.3557 17 C 1.0481 -2.0612 -0.4366 C.3 1 UNL1111111111 -0.2720 18 C -4.2106 -0.6879 0.5700 C.3 1 UNL1111111111 0.3747 19 C 0.0869 -2.7065 -1.4434 C.3 1 UNL1111111111 -0.2570 20 C 4.3427 -0.3722 0.5534 C.2 1 UNL1111111111 0.5441 21 C -4.9358 -0.5892 -0.7670 C.3 1 UNL1111111111 -0.5089 22 C -3.3811 -1.9590 0.7021 C.3 1 UNL1111111111 -0.5126 23 C -5.1635 -0.4999 1.7549 C.3 1 UNL1111111111 -0.4806 24 C -0.5054 -3.9955 -0.8734 C.3 1 UNL1111111111 -0.4370 25 H -1.5708 1.9279 1.5237 H 1 UNL1111111111 0.1919 26 H -3.0027 3.0701 -0.6180 H 1 UNL1111111111 0.1546 27 H -1.8218 4.0007 0.3082 H 1 UNL1111111111 0.1552 28 H 1.1325 2.7462 -1.3373 H 1 UNL1111111111 0.1380 29 H 0.1660 1.4225 -2.0890 H 1 UNL1111111111 0.1458 30 H -0.6571 4.2326 -1.7257 H 1 UNL1111111111 0.1438 31 H -1.5651 2.9224 -2.4908 H 1 UNL1111111111 0.1513 32 H 2.4695 1.1623 -0.5207 H 1 UNL1111111111 0.1598 33 H 2.6598 -1.1045 -1.5314 H 1 UNL1111111111 0.1602 34 H 1.0703 -0.3959 -1.8396 H 1 UNL1111111111 0.1445 35 H 2.9281 0.4980 1.9725 H 1 UNL1111111111 0.1725 36 H 2.5919 -1.1663 1.5200 H 1 UNL1111111111 0.2046 37 H 1.8246 -2.7885 -0.1313 H 1 UNL1111111111 0.1465 38 H 0.4926 -1.8135 0.4897 H 1 UNL1111111111 0.1556 39 H -0.7275 -1.9950 -1.6930 H 1 UNL1111111111 0.1496 40 H 0.6114 -2.9175 -2.3930 H 1 UNL1111111111 0.1321 41 H -5.7202 -1.3481 -0.8513 H 1 UNL1111111111 0.1557 42 H -5.4020 0.3936 -0.8975 H 1 UNL1111111111 0.1546 43 H -4.2448 -0.7354 -1.6105 H 1 UNL1111111111 0.1779 44 H -2.7387 -1.9232 1.5921 H 1 UNL1111111111 0.1675 45 H -4.0161 -2.8467 0.7784 H 1 UNL1111111111 0.1571 46 H -2.7160 -2.1003 -0.1637 H 1 UNL1111111111 0.1786 47 H -5.6964 0.4558 1.6887 H 1 UNL1111111111 0.1568 48 H -4.6136 -0.4956 2.7051 H 1 UNL1111111111 0.1646 49 H -5.9051 -1.3028 1.7941 H 1 UNL1111111111 0.1531 50 H -1.0291 -3.8100 0.0714 H 1 UNL1111111111 0.1418 51 H -1.2244 -4.4415 -1.5686 H 1 UNL1111111111 0.1376 52 H 0.2735 -4.7406 -0.6773 H 1 UNL1111111111 0.1422 53 H 5.0628 1.5384 1.1481 H 1 UNL1111111111 0.3042 54 H 6.5046 -0.0478 -0.5466 H 1 UNL1111111111 0.3134 @BOND 1 1 15 1 2 1 18 1 3 2 13 2 4 3 15 2 5 4 20 2 6 5 7 1 7 5 54 1 8 6 8 1 9 6 10 1 10 6 13 am 11 7 20 am 12 7 53 1 13 8 9 1 14 8 15 1 15 8 25 1 16 9 11 1 17 9 26 1 18 9 27 1 19 10 11 1 20 10 28 1 21 10 29 1 22 11 30 1 23 11 31 1 24 12 13 1 25 12 14 1 26 12 16 1 27 12 32 1 28 14 17 1 29 14 33 1 30 14 34 1 31 16 20 1 32 16 35 1 33 16 36 1 34 17 19 1 35 17 37 1 36 17 38 1 37 18 21 1 38 18 22 1 39 18 23 1 40 19 24 1 41 19 39 1 42 19 40 1 43 21 41 1 44 21 42 1 45 21 43 1 46 22 44 1 47 22 45 1 48 22 46 1 49 23 47 1 50 23 48 1 51 23 49 1 52 24 50 1 53 24 51 1 54 24 52 1