@MOLECULE 4-[2-oxo-2-({(s)-phenyl[2-(1-piperidinyl)phenyl]methyl}amino)ethyl]benzoic acid 60 63 0 0 0 SMALL GASTEIGER @ATOM 1 O -0.5921 2.4669 -1.0729 O.2 1 UNL1111111111 -0.5171 2 O 6.5728 -0.1748 -0.7394 O.3 1 UNL1111111111 -0.5580 3 O 6.2394 -1.0816 1.2651 O.2 1 UNL1111111111 -0.5041 4 N -3.8337 0.1222 0.1300 N.pl3 1 UNL1111111111 -0.4427 5 N -0.2102 0.8497 0.4769 N.am 1 UNL1111111111 -0.6076 6 C -3.7289 1.5268 0.6018 C.3 1 UNL1111111111 -0.0888 7 C -5.2262 -0.2300 -0.2242 C.3 1 UNL1111111111 -0.0923 8 C -4.1265 2.4583 -0.5563 C.3 1 UNL1111111111 -0.2716 9 C -5.6520 0.6601 -1.4092 C.3 1 UNL1111111111 -0.2677 10 C -5.5501 2.1427 -1.0294 C.3 1 UNL1111111111 -0.2636 11 C -3.1671 -0.8014 0.9909 C.ar 1 UNL1111111111 0.1797 12 C -1.7783 -0.9587 0.8228 C.ar 1 UNL1111111111 -0.0896 13 C -1.0257 -0.1568 -0.2170 C.3 1 UNL1111111111 0.0727 14 C -3.8417 -1.5904 1.9334 C.ar 1 UNL1111111111 -0.2451 15 C -1.0906 -1.8841 1.6062 C.ar 1 UNL1111111111 -0.1215 16 C -0.1942 -1.0935 -1.0728 C.ar 1 UNL1111111111 -0.0278 17 C -3.1411 -2.5136 2.7028 C.ar 1 UNL1111111111 -0.1034 18 C -1.7650 -2.6591 2.5459 C.ar 1 UNL1111111111 -0.1842 19 C -0.8704 -1.8702 -2.0178 C.ar 1 UNL1111111111 -0.1520 20 C 1.1887 -1.2069 -0.9435 C.ar 1 UNL1111111111 -0.1703 21 C 0.0267 2.0769 -0.1078 C.2 1 UNL1111111111 0.6011 22 C 1.1161 2.9083 0.5623 C.3 1 UNL1111111111 -0.3929 23 C -0.1641 -2.7586 -2.8228 C.ar 1 UNL1111111111 -0.1335 24 C 1.8941 -2.0958 -1.7535 C.ar 1 UNL1111111111 -0.1385 25 C 2.3933 2.1316 0.5396 C.ar 1 UNL1111111111 0.0708 26 C 1.2199 -2.8731 -2.6917 C.ar 1 UNL1111111111 -0.1582 27 C 2.8287 1.4598 1.6859 C.ar 1 UNL1111111111 -0.2240 28 C 3.1147 2.0263 -0.6527 C.ar 1 UNL1111111111 -0.2005 29 C 3.9685 0.6647 1.6319 C.ar 1 UNL1111111111 -0.0607 30 C 4.2586 1.2364 -0.7083 C.ar 1 UNL1111111111 -0.0478 31 C 4.6774 0.5494 0.4330 C.ar 1 UNL1111111111 -0.1639 32 C 5.8639 -0.3158 0.4137 C.2 1 UNL1111111111 0.6427 33 H -2.6776 1.7278 0.9056 H 1 UNL1111111111 0.1494 34 H -4.3681 1.7131 1.4900 H 1 UNL1111111111 0.1133 35 H -5.9333 -0.1009 0.6217 H 1 UNL1111111111 0.1124 36 H -5.2538 -1.3001 -0.5245 H 1 UNL1111111111 0.1391 37 H -3.4061 2.3297 -1.3923 H 1 UNL1111111111 0.1684 38 H -4.0391 3.5113 -0.2392 H 1 UNL1111111111 0.1326 39 H -6.6788 0.4041 -1.7196 H 1 UNL1111111111 0.1276 40 H -4.9955 0.4521 -2.2777 H 1 UNL1111111111 0.1557 41 H -5.8127 2.7771 -1.8951 H 1 UNL1111111111 0.1322 42 H -6.2809 2.3875 -0.2378 H 1 UNL1111111111 0.1296 43 H -1.7508 0.3929 -0.9027 H 1 UNL1111111111 0.2170 44 H -4.9131 -1.4776 2.0736 H 1 UNL1111111111 0.1552 45 H -0.0171 -2.0189 1.4654 H 1 UNL1111111111 0.1566 46 H 0.3391 0.5226 1.2570 H 1 UNL1111111111 0.3134 47 H -3.6725 -3.1227 3.4325 H 1 UNL1111111111 0.1475 48 H -1.2189 -3.3810 3.1484 H 1 UNL1111111111 0.1531 49 H -1.9520 -1.7801 -2.1189 H 1 UNL1111111111 0.1618 50 H 1.7346 -0.6016 -0.2228 H 1 UNL1111111111 0.1500 51 H 1.2165 3.8714 0.0124 H 1 UNL1111111111 0.1906 52 H 0.8067 3.1966 1.5864 H 1 UNL1111111111 0.1762 53 H -0.6925 -3.3642 -3.5559 H 1 UNL1111111111 0.1465 54 H 2.9738 -2.1808 -1.6500 H 1 UNL1111111111 0.1470 55 H 1.7709 -3.5669 -3.3214 H 1 UNL1111111111 0.1453 56 H 2.2814 1.5566 2.6215 H 1 UNL1111111111 0.1610 57 H 2.7708 2.5499 -1.5455 H 1 UNL1111111111 0.1729 58 H 4.3115 0.1247 2.5192 H 1 UNL1111111111 0.1728 59 H 4.8221 1.1472 -1.6416 H 1 UNL1111111111 0.1766 60 H 7.3764 -0.7506 -0.7738 H 1 UNL1111111111 0.3569 @BOND 1 1 21 2 2 2 32 1 3 2 60 1 4 3 32 2 5 4 6 1 6 4 7 1 7 4 11 1 8 5 13 1 9 5 21 am 10 5 46 1 11 6 8 1 12 6 33 1 13 6 34 1 14 7 9 1 15 7 35 1 16 7 36 1 17 8 10 1 18 8 37 1 19 8 38 1 20 9 10 1 21 9 39 1 22 9 40 1 23 10 41 1 24 10 42 1 25 11 12 ar 26 11 14 ar 27 12 13 1 28 12 15 ar 29 13 16 1 30 13 43 1 31 14 17 ar 32 14 44 1 33 15 18 ar 34 15 45 1 35 16 19 ar 36 16 20 ar 37 17 18 ar 38 17 47 1 39 18 48 1 40 19 23 ar 41 19 49 1 42 20 24 ar 43 20 50 1 44 21 22 1 45 22 25 1 46 22 51 1 47 22 52 1 48 23 26 ar 49 23 53 1 50 24 26 ar 51 24 54 1 52 25 27 ar 53 25 28 ar 54 26 55 1 55 27 29 ar 56 27 56 1 57 28 30 ar 58 28 57 1 59 29 31 ar 60 29 58 1 61 30 31 ar 62 30 59 1 63 31 32 1