@MOLECULE 3-[3-[4-(3-chlorophenyl)phenyl]isoxazol-5-yl]propanoic acid 37 39 0 0 0 SMALL GASTEIGER @ATOM 1 C -5.9295 0.7194 -0.4857 C.3 1 UNL11111 -0.3371 2 CL 6.5760 2.3847 -0.1750 Cl 1 UNL11111 -0.0871 3 C -5.4116 -0.1639 0.6551 C.3 1 UNL11111 -0.2715 4 O -7.8888 1.1759 0.8906 O.2 1 UNL11111 -0.5009 5 C -4.0187 -0.5572 0.3993 C.ar 1 UNL11111 0.0819 6 C -2.7927 0.0157 0.6086 C.ar 1 UNL11111 -0.3145 7 C -1.8401 -0.9514 0.0924 C.ar 1 UNL11111 0.0953 8 C -0.3913 -0.8286 0.0738 C.ar 1 UNL11111 -0.0281 9 C 0.3554 -1.4819 -0.9130 C.ar 1 UNL11111 -0.1088 10 C 1.7415 -1.3667 -0.9261 C.ar 1 UNL11111 -0.1541 11 C 2.3876 -0.5976 0.0453 C.ar 1 UNL11111 -0.0034 12 C 1.6429 0.0560 1.0308 C.ar 1 UNL11111 -0.1528 13 C 0.2571 -0.0605 1.0468 C.ar 1 UNL11111 -0.1240 14 C -7.2809 1.2591 -0.1426 C.2 1 UNL11111 0.6450 15 N -2.5082 -2.0063 -0.3800 N.ar 1 UNL11111 -0.2394 16 O -3.8509 -1.7928 -0.2028 O.2 1 UNL11111 0.0330 17 C 3.8508 -0.4819 0.0317 C.ar 1 UNL11111 0.0078 18 C 4.4499 0.7780 -0.0533 C.ar 1 UNL11111 -0.1836 19 C 5.8356 0.8448 -0.0671 C.ar 1 UNL11111 0.0354 20 C 6.6468 -0.2803 0.0039 C.ar 1 UNL11111 -0.1769 21 C 6.0336 -1.5297 0.0912 C.ar 1 UNL11111 -0.1170 22 C 4.6441 -1.6313 0.1029 C.ar 1 UNL11111 -0.1644 23 H -5.2307 1.5629 -0.6898 H 1 UNL11111 0.1912 24 H -5.9710 0.1527 -1.4437 H 1 UNL11111 0.1923 25 H -5.4939 0.3763 1.6302 H 1 UNL11111 0.1898 26 H -6.0701 -1.0560 0.7792 H 1 UNL11111 0.1814 27 H -2.5482 0.9596 1.0420 H 1 UNL11111 0.1857 28 H -0.1531 -2.0859 -1.6673 H 1 UNL11111 0.1716 29 H 2.3236 -1.8729 -1.6954 H 1 UNL11111 0.1625 30 H 2.1498 0.6492 1.7911 H 1 UNL11111 0.1624 31 H -0.3215 0.4406 1.8221 H 1 UNL11111 0.1578 32 H 3.8359 1.6768 -0.1143 H 1 UNL11111 0.1787 33 H 7.7327 -0.1963 -0.0080 H 1 UNL11111 0.1717 34 H 6.6453 -2.4296 0.1502 H 1 UNL11111 0.1582 35 H 4.1696 -2.6100 0.1742 H 1 UNL11111 0.1654 36 O -7.7985 1.9208 -1.2101 O.3 1 UNL11111 -0.5619 37 H -8.6923 2.3100 -1.0428 H 1 UNL11111 0.3584 @BOND 1 1 14 1 2 1 3 1 3 1 23 1 4 1 24 1 5 3 5 1 6 3 25 1 7 3 26 1 8 5 16 ar 9 6 5 ar 10 6 7 ar 11 6 27 1 12 7 8 1 13 7 15 ar 14 8 9 ar 15 9 10 ar 16 9 28 1 17 10 29 1 18 11 17 1 19 11 10 ar 20 12 11 ar 21 12 30 1 22 13 12 ar 23 13 8 ar 24 13 31 1 25 14 4 2 26 14 36 1 27 16 15 ar 28 17 18 ar 29 18 19 ar 30 18 32 1 31 19 2 1 32 20 19 ar 33 20 33 1 34 21 20 ar 35 21 34 1 36 22 21 ar 37 22 17 ar 38 22 35 1 39 36 37 1