@MOLECULE 3-hydroxy-4-nitrobenzaldehyde 17 17 0 0 0 SMALL GASTEIGER @ATOM 1 O 1.1231 -2.1514 -0.0012 O.3 1 UNL11111111111 -0.4444 2 O 2.7439 1.6429 0.0016 O.2 1 UNL11111111111 -0.3511 3 O 3.0892 -0.4774 0.0025 O.2 1 UNL11111111111 -0.4687 4 O -4.0799 0.6025 0.0018 O.2 1 UNL11111111111 -0.3888 5 N 2.3332 0.4998 0.0001 N.pl3 1 UNL11111111111 0.6552 6 C 0.9148 0.2641 -0.0016 C.ar 1 UNL11111111111 -0.2488 7 C 0.3851 -1.0407 -0.0014 C.ar 1 UNL11111111111 0.3624 8 C -1.8459 -0.1438 0.0000 C.ar 1 UNL11111111111 -0.0329 9 C -1.0108 -1.2442 0.0000 C.ar 1 UNL11111111111 -0.2485 10 C 0.0388 1.3671 -0.0027 C.ar 1 UNL11111111111 -0.0277 11 C -1.3276 1.1624 -0.0019 C.ar 1 UNL11111111111 -0.1935 12 C -3.3261 -0.3380 0.0014 C.2 1 UNL11111111111 0.3179 13 H -1.3881 -2.2672 0.0019 H 1 UNL11111111111 0.1886 14 H 0.4527 2.3835 -0.0036 H 1 UNL11111111111 0.1872 15 H -2.0203 2.0084 -0.0025 H 1 UNL11111111111 0.1896 16 H -3.7021 -1.3692 0.0015 H 1 UNL11111111111 0.1243 17 H 2.1210 -1.9366 -0.0004 H 1 UNL11111111111 0.3793 @BOND 1 1 7 1 2 1 17 1 3 2 5 2 4 3 5 2 5 4 12 2 6 5 6 1 7 6 7 ar 8 6 10 ar 9 7 9 ar 10 8 9 ar 11 8 11 ar 12 8 12 1 13 9 13 1 14 10 11 ar 15 10 14 1 16 11 15 1 17 12 16 1