@MOLECULE (2s)-3-{4-[3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)propyl]phenyl}-2-(1h-pyrrol-1-yl)propanoic acid 57 60 0 0 0 SMALL GASTEIGER @ATOM 1 O 6.0111 1.8061 -0.9832 O.3 1 UNL1111111111 -0.5451 2 C 5.8425 1.0764 0.1417 C.2 1 UNL1111111111 0.6114 3 O 5.8727 1.5662 1.2358 O.2 1 UNL1111111111 -0.4821 4 C 5.6157 -0.3903 -0.2341 C.3 1 UNL1111111111 0.0106 5 N 6.7994 -1.1423 0.1335 N.ar 1 UNL1111111111 -0.2426 6 C 7.6107 -1.8409 -0.7572 C.ar 1 UNL1111111111 -0.0903 7 C 8.6405 -2.4209 -0.0230 C.ar 1 UNL1111111111 -0.2170 8 C 8.4512 -2.0654 1.3443 C.ar 1 UNL1111111111 -0.2228 9 C 7.3097 -1.2745 1.4221 C.ar 1 UNL1111111111 -0.0784 10 C 4.3668 -0.9047 0.5156 C.3 1 UNL1111111111 -0.3063 11 C 3.1404 -0.2184 0.0026 C.ar 1 UNL1111111111 -0.0316 12 C 2.4835 -0.7066 -1.1278 C.ar 1 UNL1111111111 -0.1470 13 C 1.3463 -0.0619 -1.6064 C.ar 1 UNL1111111111 -0.1732 14 C 0.8591 1.0749 -0.9582 C.ar 1 UNL1111111111 0.0236 15 C 1.5174 1.5610 0.1742 C.ar 1 UNL1111111111 -0.1752 16 C 2.6532 0.9167 0.6535 C.ar 1 UNL1111111111 -0.1460 17 C -0.3744 1.7611 -1.4582 C.3 1 UNL1111111111 -0.2935 18 C -1.6002 1.2286 -0.7021 C.3 1 UNL1111111111 -0.2492 19 C -2.8805 1.9348 -1.1767 C.3 1 UNL1111111111 -0.2474 20 C -4.0428 1.4242 -0.4196 C.ar 1 UNL1111111111 0.0256 21 C -4.5688 1.8235 0.7895 C.ar 1 UNL1111111111 0.0821 22 C -4.2779 2.8543 1.7833 C.3 1 UNL1111111111 -0.4315 23 O -5.6485 1.0054 1.0830 O.2 1 UNL1111111111 -0.2420 24 C -5.7410 0.1136 0.0144 C.ar 1 UNL1111111111 0.2577 25 N -4.8058 0.3398 -0.8898 N.ar 1 UNL1111111111 -0.3958 26 C -6.7958 -0.8718 0.0796 C.ar 1 UNL1111111111 -0.0499 27 C -6.8900 -1.8361 -0.9308 C.ar 1 UNL1111111111 -0.0980 28 C -7.8973 -2.7948 -0.8763 C.ar 1 UNL1111111111 -0.1591 29 C -8.8083 -2.7921 0.1793 C.ar 1 UNL1111111111 -0.1207 30 C -8.7140 -1.8299 1.1844 C.ar 1 UNL1111111111 -0.1559 31 C -7.7087 -0.8679 1.1392 C.ar 1 UNL1111111111 -0.1159 32 H 6.1611 2.7719 -0.8182 H 1 UNL1111111111 0.3594 33 H 5.4482 -0.4710 -1.3480 H 1 UNL1111111111 0.1910 34 H 7.4120 -1.8741 -1.8079 H 1 UNL1111111111 0.1622 35 H 9.4361 -3.0225 -0.4043 H 1 UNL1111111111 0.1582 36 H 9.0824 -2.3557 2.1555 H 1 UNL1111111111 0.1600 37 H 6.8541 -0.7979 2.2682 H 1 UNL1111111111 0.1736 38 H 4.2899 -2.0067 0.3924 H 1 UNL1111111111 0.1740 39 H 4.4847 -0.7506 1.6109 H 1 UNL1111111111 0.1767 40 H 2.8561 -1.5938 -1.6362 H 1 UNL1111111111 0.1514 41 H 0.8333 -0.4481 -2.4848 H 1 UNL1111111111 0.1538 42 H 1.1393 2.4443 0.6848 H 1 UNL1111111111 0.1531 43 H 3.1651 1.3016 1.5368 H 1 UNL1111111111 0.1639 44 H -0.2928 2.8592 -1.3299 H 1 UNL1111111111 0.1490 45 H -0.5042 1.6038 -2.5481 H 1 UNL1111111111 0.1513 46 H -1.6985 0.1349 -0.8566 H 1 UNL1111111111 0.1573 47 H -1.4675 1.3659 0.3872 H 1 UNL1111111111 0.1418 48 H -2.7863 3.0330 -1.0565 H 1 UNL1111111111 0.1464 49 H -3.0273 1.7575 -2.2662 H 1 UNL1111111111 0.1683 50 H -4.5562 3.8588 1.4200 H 1 UNL1111111111 0.1705 51 H -4.8294 2.6902 2.7256 H 1 UNL1111111111 0.1760 52 H -3.2045 2.8827 2.0368 H 1 UNL1111111111 0.1721 53 H -6.1711 -1.8280 -1.7540 H 1 UNL1111111111 0.1760 54 H -7.9725 -3.5467 -1.6597 H 1 UNL1111111111 0.1540 55 H -9.5955 -3.5429 0.2191 H 1 UNL1111111111 0.1482 56 H -9.4276 -1.8296 2.0064 H 1 UNL1111111111 0.1541 57 H -7.6336 -0.1156 1.9246 H 1 UNL1111111111 0.1632 @BOND 1 1 2 1 2 1 32 1 3 2 4 1 4 2 3 2 5 4 10 1 6 4 5 1 7 4 33 1 8 5 6 ar 9 5 9 ar 10 6 7 ar 11 6 34 1 12 7 8 ar 13 7 35 1 14 8 9 ar 15 8 36 1 16 9 37 1 17 10 11 1 18 10 38 1 19 10 39 1 20 11 12 ar 21 11 16 ar 22 12 13 ar 23 12 40 1 24 13 14 ar 25 13 41 1 26 14 17 1 27 14 15 ar 28 15 16 ar 29 15 42 1 30 16 43 1 31 17 18 1 32 17 44 1 33 17 45 1 34 18 19 1 35 18 46 1 36 18 47 1 37 19 20 1 38 19 48 1 39 19 49 1 40 20 21 ar 41 20 25 ar 42 21 23 ar 43 21 22 1 44 22 50 1 45 22 51 1 46 22 52 1 47 23 24 ar 48 24 26 1 49 24 25 ar 50 26 31 ar 51 26 27 ar 52 27 28 ar 53 27 53 1 54 28 29 ar 55 28 54 1 56 29 30 ar 57 29 55 1 58 30 31 ar 59 30 56 1 60 31 57 1