@MOLECULE 2-hydroxy-5-octanoyl-n-[3-(trifluoromethyl)phenyl]benzamide 53 54 0 0 0 SMALL GASTEIGER @ATOM 1 F -5.5426 3.9202 0.4083 F 1 UNL1111111111 -0.1992 2 F -4.8627 2.8229 2.0683 F 1 UNL1111111111 -0.2033 3 F -3.4847 3.8345 0.8335 F 1 UNL1111111111 -0.2041 4 O 4.0970 -2.7673 1.0932 O.2 1 UNL1111111111 -0.4551 5 O -1.8522 -4.5732 0.1879 O.3 1 UNL1111111111 -0.4465 6 O -1.9240 -2.1926 -2.0264 O.2 1 UNL1111111111 -0.4670 7 N -2.2220 -1.1098 -0.0362 N.am 1 UNL1111111111 -0.5778 8 C 4.9905 1.1557 -0.2331 C.3 1 UNL1111111111 -0.2748 9 C 6.4238 1.6406 0.0190 C.3 1 UNL1111111111 -0.2750 10 C 4.8035 -0.2662 0.3070 C.3 1 UNL1111111111 -0.2506 11 C 6.6181 3.0630 -0.5204 C.3 1 UNL1111111111 -0.2737 12 C 3.3756 -0.7591 0.0519 C.3 1 UNL1111111111 -0.3772 13 C 8.0511 3.5497 -0.2664 C.3 1 UNL1111111111 -0.2502 14 C 3.1915 -2.1615 0.5721 C.2 1 UNL1111111111 0.4808 15 C 8.2471 4.9690 -0.7993 C.3 1 UNL1111111111 -0.4401 16 C 1.8551 -2.7929 0.4351 C.ar 1 UNL1111111111 -0.2484 17 C 0.7750 -2.1271 -0.1416 C.ar 1 UNL1111111111 -0.0032 18 C -0.4690 -2.7462 -0.2202 C.ar 1 UNL1111111111 -0.2739 19 C 1.6957 -4.1022 0.9126 C.ar 1 UNL1111111111 0.0281 20 C -0.6123 -4.0511 0.2695 C.ar 1 UNL1111111111 0.3626 21 C 0.4669 -4.7428 0.8331 C.ar 1 UNL1111111111 -0.3419 22 C -1.6001 -2.0411 -0.8748 C.2 1 UNL1111111111 0.6187 23 C -3.2421 -0.2263 -0.4473 C.ar 1 UNL1111111111 0.2160 24 C -3.4383 0.9315 0.3243 C.ar 1 UNL1111111111 -0.2084 25 C -4.4234 1.8414 -0.0508 C.ar 1 UNL1111111111 -0.0864 26 C -4.0460 -0.4632 -1.5730 C.ar 1 UNL1111111111 -0.1713 27 C -5.2201 1.6186 -1.1694 C.ar 1 UNL1111111111 -0.1428 28 C -5.0236 0.4598 -1.9229 C.ar 1 UNL1111111111 -0.1142 29 C -4.5835 3.0781 0.7887 C.3 1 UNL1111111111 0.5452 30 H 4.7684 1.1859 -1.3162 H 1 UNL1111111111 0.1369 31 H 4.2702 1.8449 0.2457 H 1 UNL1111111111 0.1357 32 H 7.1466 0.9526 -0.4584 H 1 UNL1111111111 0.1392 33 H 6.6490 1.6121 1.1017 H 1 UNL1111111111 0.1388 34 H 5.5319 -0.9582 -0.1606 H 1 UNL1111111111 0.1528 35 H 5.0292 -0.3025 1.3909 H 1 UNL1111111111 0.1505 36 H 6.3961 3.0931 -1.6032 H 1 UNL1111111111 0.1362 37 H 5.8961 3.7522 -0.0447 H 1 UNL1111111111 0.1362 38 H 3.1557 -0.7300 -1.0360 H 1 UNL1111111111 0.1700 39 H 2.6494 -0.0748 0.5359 H 1 UNL1111111111 0.1654 40 H 8.7745 2.8629 -0.7452 H 1 UNL1111111111 0.1344 41 H 8.2749 3.5185 0.8168 H 1 UNL1111111111 0.1344 42 H 8.0673 5.0199 -1.8790 H 1 UNL1111111111 0.1425 43 H 9.2677 5.3236 -0.6185 H 1 UNL1111111111 0.1411 44 H 7.5627 5.6760 -0.3175 H 1 UNL1111111111 0.1426 45 H 0.8896 -1.1148 -0.5407 H 1 UNL1111111111 0.1657 46 H 2.5592 -4.6166 1.3546 H 1 UNL1111111111 0.1786 47 H 0.3452 -5.7570 1.2007 H 1 UNL1111111111 0.1725 48 H -1.9086 -1.0331 0.9271 H 1 UNL1111111111 0.3210 49 H -2.8168 1.1159 1.1999 H 1 UNL1111111111 0.1708 50 H -3.9091 -1.3665 -2.1748 H 1 UNL1111111111 0.1974 51 H -5.9922 2.3248 -1.4715 H 1 UNL1111111111 0.1709 52 H -5.6471 0.2761 -2.7995 H 1 UNL1111111111 0.1612 53 H -1.8942 -5.5154 0.4979 H 1 UNL1111111111 0.3388 @BOND 1 1 29 1 2 2 29 1 3 3 29 1 4 4 14 2 5 5 20 1 6 5 53 1 7 6 22 2 8 7 22 am 9 7 23 1 10 7 48 1 11 8 9 1 12 8 10 1 13 8 30 1 14 8 31 1 15 9 11 1 16 9 32 1 17 9 33 1 18 10 12 1 19 10 34 1 20 10 35 1 21 11 13 1 22 11 36 1 23 11 37 1 24 12 14 1 25 12 38 1 26 12 39 1 27 13 15 1 28 13 40 1 29 13 41 1 30 14 16 1 31 15 42 1 32 15 43 1 33 15 44 1 34 16 17 ar 35 16 19 ar 36 17 18 ar 37 17 45 1 38 18 20 ar 39 18 22 1 40 19 21 ar 41 19 46 1 42 20 21 ar 43 21 47 1 44 23 24 ar 45 23 26 ar 46 24 25 ar 47 24 49 1 48 25 27 ar 49 25 29 1 50 26 28 ar 51 26 50 1 52 27 28 ar 53 27 51 1 54 28 52 1