@MOLECULE 2-methyl-2-propanyl 4-({[4-(2-butyn-1-ylamino)phenyl]sulfonyl}methyl)-4-(hydroxycarbamoyl)-1-piperidinecarboxylate 63 64 0 0 0 SMALL GASTEIGER @ATOM 1 C 10.9663 -1.0974 -0.7227 C.3 1 UNL1111111111 -0.4130 2 C 9.5577 -1.3053 -0.6320 C.1 1 UNL1111111111 0.0058 3 C 8.3622 -1.4885 -0.5538 C.1 1 UNL1111111111 -0.1986 4 C 6.9478 -1.7255 -0.4540 C.3 1 UNL1111111111 -0.0188 5 N 6.2035 -0.4560 -0.5621 N.pl3 1 UNL1111111111 -0.5313 6 C 4.9218 -0.3254 -0.0894 C.ar 1 UNL1111111111 0.3215 7 C 4.3444 0.9708 -0.0521 C.ar 1 UNL1111111111 -0.3447 8 C 3.0365 1.1309 0.3653 C.ar 1 UNL1111111111 0.0394 9 C 2.2679 0.0245 0.7452 C.ar 1 UNL1111111111 -0.5366 10 C 2.8411 -1.2493 0.7309 C.ar 1 UNL1111111111 0.0340 11 C 4.1475 -1.4384 0.3121 C.ar 1 UNL1111111111 -0.3528 12 S 0.6225 0.2240 1.2646 S.O2 1 UNL1111111111 2.2668 13 O 0.2201 -0.9511 2.0090 O.2 1 UNL1111111111 -0.9088 14 O 0.4632 1.5511 1.8549 O.2 1 UNL1111111111 -0.9674 15 C -0.3243 0.2087 -0.2788 C.3 1 UNL1111111111 -0.6239 16 C -1.6340 1.0199 -0.3409 C.3 1 UNL1111111111 0.0435 17 C -2.3850 1.0510 1.0012 C.3 1 UNL1111111111 -0.3510 18 C -3.8232 1.5840 0.8620 C.3 1 UNL1111111111 -0.0833 19 N -4.5891 0.8304 -0.1503 N.am 1 UNL1111111111 -0.4458 20 C -3.9456 0.9099 -1.4718 C.3 1 UNL1111111111 -0.0898 21 C -2.5103 0.3554 -1.4357 C.3 1 UNL1111111111 -0.3143 22 C -5.0281 -0.4284 0.2893 C.2 1 UNL1111111111 0.7227 23 O -5.3678 -0.6732 1.4252 O.2 1 UNL1111111111 -0.5591 24 O -5.0964 -1.2990 -0.7481 O.3 1 UNL1111111111 -0.4895 25 C -5.6043 -2.6335 -0.5284 C.3 1 UNL1111111111 0.3785 26 C -4.6740 -3.3641 0.4344 C.3 1 UNL1111111111 -0.5150 27 C -7.0412 -2.5646 -0.0293 C.3 1 UNL1111111111 -0.5081 28 C -5.5217 -3.2096 -1.9481 C.3 1 UNL1111111111 -0.4824 29 C -1.3563 2.4682 -0.7844 C.2 1 UNL1111111111 0.5135 30 O -1.9317 2.9923 -1.7216 O.2 1 UNL1111111111 -0.5590 31 N -0.2976 3.1399 -0.1883 N.am 1 UNL1111111111 -0.4060 32 O -0.2372 4.5164 -0.4201 O.3 1 UNL1111111111 -0.2946 33 H 11.5356 -2.0083 -0.4537 H 1 UNL1111111111 0.1769 34 H 11.2814 -0.8142 -1.7452 H 1 UNL1111111111 0.1750 35 H 11.3127 -0.2938 -0.0447 H 1 UNL1111111111 0.1763 36 H 6.5996 -2.4121 -1.2749 H 1 UNL1111111111 0.1651 37 H 6.7079 -2.2386 0.5175 H 1 UNL1111111111 0.1627 38 H 6.7555 0.3662 -0.7573 H 1 UNL1111111111 0.3173 39 H 4.9331 1.8326 -0.3484 H 1 UNL1111111111 0.1609 40 H 2.6115 2.1437 0.4008 H 1 UNL1111111111 0.1697 41 H 2.2624 -2.1235 1.0600 H 1 UNL1111111111 0.1651 42 H 4.5661 -2.4374 0.2940 H 1 UNL1111111111 0.1597 43 H 0.3301 0.5241 -1.1159 H 1 UNL1111111111 0.1816 44 H -0.5560 -0.8590 -0.4876 H 1 UNL1111111111 0.1879 45 H -2.4230 0.0275 1.4353 H 1 UNL1111111111 0.1783 46 H -1.8513 1.6692 1.7556 H 1 UNL1111111111 0.1844 47 H -4.3535 1.5246 1.8422 H 1 UNL1111111111 0.1705 48 H -3.8261 2.6554 0.5570 H 1 UNL1111111111 0.1558 49 H -4.5575 0.3621 -2.2224 H 1 UNL1111111111 0.1557 50 H -3.9497 1.9819 -1.7887 H 1 UNL1111111111 0.1784 51 H -2.0436 0.4988 -2.4288 H 1 UNL1111111111 0.1566 52 H -2.5603 -0.7379 -1.2626 H 1 UNL1111111111 0.1524 53 H -4.7473 -2.9488 1.4521 H 1 UNL1111111111 0.1837 54 H -4.9179 -4.4292 0.4963 H 1 UNL1111111111 0.1592 55 H -3.6266 -3.2710 0.1286 H 1 UNL1111111111 0.1525 56 H -7.6448 -1.8880 -0.6462 H 1 UNL1111111111 0.1612 57 H -7.5169 -3.5498 -0.0381 H 1 UNL1111111111 0.1543 58 H -7.0898 -2.1816 1.0025 H 1 UNL1111111111 0.1846 59 H -4.4934 -3.1901 -2.3257 H 1 UNL1111111111 0.1542 60 H -5.8745 -4.2447 -1.9711 H 1 UNL1111111111 0.1548 61 H -6.1330 -2.6239 -2.6459 H 1 UNL1111111111 0.1613 62 H 0.0063 3.0004 0.7804 H 1 UNL1111111111 0.3645 63 H -0.5605 4.6453 -1.3683 H 1 UNL1111111111 0.3076 @BOND 1 1 2 1 2 1 33 1 3 1 34 1 4 1 35 1 5 2 3 3 6 3 4 1 7 4 5 1 8 4 36 1 9 4 37 1 10 5 6 1 11 5 38 1 12 6 7 ar 13 6 11 ar 14 7 8 ar 15 7 39 1 16 8 9 ar 17 8 40 1 18 9 12 1 19 9 10 ar 20 10 11 ar 21 10 41 1 22 11 42 1 23 12 13 2 24 12 14 2 25 12 15 1 26 15 16 1 27 15 43 1 28 15 44 1 29 16 17 1 30 16 29 1 31 16 21 1 32 17 18 1 33 17 45 1 34 17 46 1 35 18 19 1 36 18 47 1 37 18 48 1 38 19 22 am 39 19 20 1 40 20 21 1 41 20 49 1 42 20 50 1 43 21 51 1 44 21 52 1 45 22 23 2 46 22 24 1 47 24 25 1 48 25 27 1 49 25 26 1 50 25 28 1 51 26 53 1 52 26 54 1 53 26 55 1 54 27 56 1 55 27 57 1 56 27 58 1 57 28 59 1 58 28 60 1 59 28 61 1 60 29 31 am 61 29 30 2 62 31 32 1 63 31 62 1 64 32 63 1