@MOLECULE n-[(2s,3r)-3-hydroxy-1-(hydroxyamino)-1-oxo-2-butanyl]-4-[4-(phenylethynyl)phenyl]-1-piperidinecarboxamide 58 60 0 0 0 SMALL GASTEIGER @ATOM 1 N 4.4112 0.2311 -0.2401 N.am 1 UNL1111111111 -0.5918 2 C 4.6875 -1.0967 0.3059 C.3 1 UNL1111111111 -0.0689 3 C 5.7203 -1.7323 -0.6271 C.2 1 UNL1111111111 0.5147 4 O 5.4721 -2.0213 -1.7766 O.2 1 UNL1111111111 -0.4977 5 N 6.9145 -2.1309 -0.0206 N.am 1 UNL1111111111 -0.3850 6 O 7.9475 -2.4670 -0.9014 O.3 1 UNL1111111111 -0.2864 7 C 3.8353 1.1494 0.6487 C.2 1 UNL1111111111 0.7141 8 O 3.8554 0.9249 1.8511 O.2 1 UNL1111111111 -0.5994 9 N 3.4072 2.3898 0.1315 N.am 1 UNL1111111111 -0.4600 10 C 2.8296 2.4303 -1.2266 C.3 1 UNL1111111111 -0.0876 11 C 1.4192 1.8188 -1.2512 C.3 1 UNL1111111111 -0.3251 12 C 0.5105 2.5802 -0.2664 C.3 1 UNL1111111111 -0.1080 13 C 1.1355 2.6154 1.1413 C.3 1 UNL1111111111 -0.3178 14 C 2.5732 3.1600 1.0845 C.3 1 UNL1111111111 -0.0781 15 C -0.8471 1.9352 -0.2155 C.ar 1 UNL1111111111 0.0049 16 C -1.9689 2.6714 -0.6042 C.ar 1 UNL1111111111 -0.1824 17 C -3.2351 2.0981 -0.5619 C.ar 1 UNL1111111111 -0.1227 18 C -3.3894 0.7745 -0.1286 C.ar 1 UNL1111111111 0.0088 19 C -2.2641 0.0342 0.2591 C.ar 1 UNL1111111111 -0.1136 20 C -1.0011 0.6139 0.2123 C.ar 1 UNL1111111111 -0.1736 21 C -4.6709 0.1984 -0.0899 C.1 1 UNL1111111111 -0.0740 22 C -5.7844 -0.2876 -0.0656 C.1 1 UNL1111111111 -0.0904 23 C -7.0798 -0.8329 -0.0445 C.ar 1 UNL1111111111 0.0262 24 C -7.2876 -2.1526 0.3790 C.ar 1 UNL1111111111 -0.1352 25 C -8.5761 -2.6788 0.3957 C.ar 1 UNL1111111111 -0.1512 26 C -9.6584 -1.8977 -0.0082 C.ar 1 UNL1111111111 -0.1410 27 C -9.4533 -0.5850 -0.4320 C.ar 1 UNL1111111111 -0.1514 28 C -8.1693 -0.0496 -0.4516 C.ar 1 UNL1111111111 -0.1362 29 C 3.3976 -1.9818 0.3234 C.3 1 UNL1111111111 0.1650 30 C 3.6029 -3.2079 1.2014 C.3 1 UNL1111111111 -0.5037 31 O 2.3270 -1.2051 0.7930 O.3 1 UNL1111111111 -0.5698 32 H 4.2081 0.2679 -1.2321 H 1 UNL1111111111 0.3201 33 H 5.0753 -0.9864 1.3570 H 1 UNL1111111111 0.1913 34 H 7.3584 -1.5920 0.7107 H 1 UNL1111111111 0.3155 35 H 7.5258 -3.0863 -1.5786 H 1 UNL1111111111 0.3118 36 H 2.7977 3.5000 -1.5424 H 1 UNL1111111111 0.1544 37 H 3.5042 1.9315 -1.9523 H 1 UNL1111111111 0.1385 38 H 0.9946 1.8580 -2.2702 H 1 UNL1111111111 0.1537 39 H 1.4611 0.7437 -0.9820 H 1 UNL1111111111 0.1661 40 H 0.4154 3.6359 -0.6284 H 1 UNL1111111111 0.1431 41 H 0.5180 3.2337 1.8176 H 1 UNL1111111111 0.1536 42 H 1.1428 1.6008 1.5875 H 1 UNL1111111111 0.1612 43 H 3.0453 3.1227 2.0946 H 1 UNL1111111111 0.1688 44 H 2.5889 4.2233 0.7611 H 1 UNL1111111111 0.1441 45 H -1.8567 3.6996 -0.9424 H 1 UNL1111111111 0.1509 46 H -4.1084 2.6725 -0.8659 H 1 UNL1111111111 0.1563 47 H -2.3830 -0.9951 0.5959 H 1 UNL1111111111 0.1608 48 H -0.1280 0.0292 0.5096 H 1 UNL1111111111 0.1676 49 H -6.4404 -2.7596 0.6933 H 1 UNL1111111111 0.1585 50 H -8.7398 -3.7033 0.7256 H 1 UNL1111111111 0.1510 51 H -10.6640 -2.3121 0.0075 H 1 UNL1111111111 0.1486 52 H -10.2994 0.0226 -0.7477 H 1 UNL1111111111 0.1508 53 H -8.0035 0.9744 -0.7817 H 1 UNL1111111111 0.1577 54 H 3.0739 -2.2454 -0.7112 H 1 UNL1111111111 0.1607 55 H 3.7855 -2.9400 2.2489 H 1 UNL1111111111 0.1587 56 H 2.7069 -3.8434 1.1885 H 1 UNL1111111111 0.1681 57 H 4.4449 -3.8208 0.8589 H 1 UNL1111111111 0.1617 58 H 2.5291 -0.8040 1.6709 H 1 UNL1111111111 0.3436 @BOND 1 1 7 am 2 1 2 1 3 1 32 1 4 2 3 1 5 2 33 1 6 3 5 am 7 4 3 2 8 5 6 1 9 5 34 1 10 6 35 1 11 7 8 2 12 9 7 am 13 9 14 1 14 10 9 1 15 10 36 1 16 10 37 1 17 11 10 1 18 11 12 1 19 11 38 1 20 11 39 1 21 12 13 1 22 12 40 1 23 13 14 1 24 13 41 1 25 13 42 1 26 14 43 1 27 14 44 1 28 15 12 1 29 16 15 ar 30 16 45 1 31 17 16 ar 32 17 46 1 33 18 17 ar 34 19 18 ar 35 19 20 ar 36 19 47 1 37 20 15 ar 38 20 48 1 39 21 18 1 40 22 21 3 41 23 22 1 42 24 23 ar 43 24 49 1 44 25 24 ar 45 25 50 1 46 26 25 ar 47 26 27 ar 48 26 51 1 49 27 28 ar 50 27 52 1 51 28 23 ar 52 28 53 1 53 29 2 1 54 29 31 1 55 29 54 1 56 30 29 1 57 30 55 1 58 30 56 1 59 30 57 1 60 31 58 1