@MOLECULE 4-nitrophenyl butyrate 26 26 0 0 0 SMALL GASTEIGER @ATOM 1 O 1.4296 0.3117 0.7956 O.3 1 UNL1111111111 -0.2765 2 O 2.0566 -0.4267 -1.2352 O.2 1 UNL1111111111 -0.3334 3 O -4.6345 0.9360 -0.4738 O.2 1 UNL1111111111 -0.2083 4 O -4.5664 -1.1711 -0.0421 O.2 1 UNL1111111111 -0.1247 5 N -4.0313 -0.0816 -0.1708 N.pl3 1 UNL1111111111 -0.0844 6 C 4.8130 -0.1917 -0.5637 C.3 1 UNL1111111111 -0.0996 7 C 3.7238 0.1552 0.4572 C.3 1 UNL1111111111 -0.2818 8 C 6.1991 0.0033 0.0436 C.3 1 UNL1111111111 -0.8880 9 C 2.3741 -0.0445 -0.1477 C.2 1 UNL1111111111 0.2910 10 C 0.1004 0.1881 0.4719 C.ar 1 UNL1111111111 0.3124 11 C -0.6109 1.3600 0.2039 C.ar 1 UNL1111111111 -0.3197 12 C -0.5026 -1.0702 0.5288 C.ar 1 UNL1111111111 -0.2593 13 C -2.5983 0.0108 0.0509 C.ar 1 UNL1111111111 0.5207 14 C -1.9804 1.2658 -0.0106 C.ar 1 UNL1111111111 -0.4075 15 C -1.8729 -1.1564 0.3185 C.ar 1 UNL1111111111 -0.3992 16 H 4.6988 0.4349 -1.4719 H 1 UNL1111111111 0.1248 17 H 4.6894 -1.2366 -0.9141 H 1 UNL1111111111 0.1501 18 H 3.8345 1.2040 0.8118 H 1 UNL1111111111 0.1959 19 H 3.8283 -0.4674 1.3736 H 1 UNL1111111111 0.2179 20 H 6.3647 1.0411 0.3553 H 1 UNL1111111111 0.2451 21 H 6.3526 -0.6350 0.9213 H 1 UNL1111111111 0.2685 22 H 6.9852 -0.2467 -0.6803 H 1 UNL1111111111 0.2553 23 H -0.0962 2.3180 0.1654 H 1 UNL1111111111 0.2372 24 H 0.0946 -1.9576 0.7305 H 1 UNL1111111111 0.2504 25 H -2.5731 2.1614 -0.2294 H 1 UNL1111111111 0.2969 26 H -2.3832 -2.1255 0.3587 H 1 UNL1111111111 0.3163 @BOND 1 1 9 1 2 1 10 1 3 2 9 2 4 3 5 2 5 4 5 2 6 5 13 1 7 6 7 1 8 6 8 1 9 6 16 1 10 6 17 1 11 7 9 1 12 7 18 1 13 7 19 1 14 8 20 1 15 8 21 1 16 8 22 1 17 10 11 ar 18 10 12 ar 19 11 14 ar 20 11 23 1 21 12 15 ar 22 12 24 1 23 13 14 ar 24 13 15 ar 25 14 25 1 26 15 26 1