@MOLECULE hyrtinadine a 40 44 0 0 0 SMALL GASTEIGER @ATOM 1 O -4.9322 2.9303 1.6764 O.3 1 UNL111111111 -0.4763 2 O 4.9173 3.0996 -1.3281 O.3 1 UNL111111111 -0.4799 3 N -4.7881 -1.6391 -1.3369 N.ar 1 UNL111111111 -0.3514 4 N 4.7675 -1.7921 1.1332 N.ar 1 UNL111111111 -0.3493 5 N 0.5935 -2.0529 0.5954 N.ar 1 UNL111111111 -0.4698 6 N 0.7918 0.0981 -0.4582 N.ar 1 UNL111111111 -0.4533 7 C -2.7648 -0.9820 -0.5455 C.ar 1 UNL111111111 -0.1497 8 C -3.7391 -0.0298 -0.0921 C.ar 1 UNL111111111 0.0193 9 C 3.7294 -0.0470 0.0695 C.ar 1 UNL111111111 0.0645 10 C 2.7497 -1.0408 0.4097 C.ar 1 UNL111111111 -0.2155 11 C -5.0036 -0.4661 -0.6030 C.ar 1 UNL111111111 0.0300 12 C 4.9903 -0.5393 0.5339 C.ar 1 UNL111111111 0.0064 13 C -1.3549 -0.9613 -0.2788 C.ar 1 UNL111111111 -0.1746 14 C -3.4335 -1.9420 -1.3006 C.ar 1 UNL111111111 -0.0063 15 C 1.3334 -0.9862 0.1652 C.ar 1 UNL111111111 0.4025 16 C 3.4208 -2.0856 1.0551 C.ar 1 UNL111111111 0.0730 17 C -3.6701 1.1260 0.6957 C.ar 1 UNL111111111 -0.2921 18 C 3.6620 1.1938 -0.5663 C.ar 1 UNL111111111 -0.2769 19 C -6.1961 0.2276 -0.3419 C.ar 1 UNL111111111 -0.1397 20 C 6.1795 0.1780 0.3623 C.ar 1 UNL111111111 -0.1352 21 C -0.7272 -2.0345 0.3769 C.ar 1 UNL111111111 0.1140 22 C -0.5340 0.1088 -0.6701 C.ar 1 UNL111111111 0.1186 23 C -4.8599 1.7914 0.9329 C.ar 1 UNL111111111 0.2728 24 C 4.8541 1.8812 -0.7243 C.ar 1 UNL111111111 0.2717 25 C -6.1171 1.3656 0.4319 C.ar 1 UNL111111111 -0.2078 26 C 6.1070 1.4008 -0.2748 C.ar 1 UNL111111111 -0.2177 27 H -3.0326 -2.8027 -1.8060 H 1 UNL111111111 0.1695 28 H -5.4888 -2.1518 -1.8180 H 1 UNL111111111 0.3119 29 H 3.0041 -3.0009 1.4543 H 1 UNL111111111 0.1869 30 H 5.4698 -2.3636 1.5398 H 1 UNL111111111 0.3128 31 H -2.7210 1.4618 1.0980 H 1 UNL111111111 0.1709 32 H 2.7044 1.5770 -0.9158 H 1 UNL111111111 0.1975 33 H -7.1439 -0.1251 -0.7408 H 1 UNL111111111 0.1564 34 H 7.1247 -0.2164 0.7215 H 1 UNL111111111 0.1533 35 H -1.2961 -2.8987 0.7399 H 1 UNL111111111 0.1764 36 H -0.9411 0.9939 -1.1745 H 1 UNL111111111 0.1806 37 H -6.9990 1.9549 0.6755 H 1 UNL111111111 0.1762 38 H 6.9918 2.0110 -0.4416 H 1 UNL111111111 0.1731 39 H -4.0470 3.2163 2.0052 H 1 UNL111111111 0.3279 40 H 4.0231 3.4190 -1.5994 H 1 UNL111111111 0.3294 @BOND 1 1 23 1 2 1 39 1 3 2 24 1 4 2 40 1 5 3 11 ar 6 3 14 ar 7 3 28 1 8 4 12 ar 9 4 16 ar 10 4 30 1 11 5 15 ar 12 5 21 ar 13 6 15 ar 14 6 22 ar 15 7 8 ar 16 7 13 1 17 7 14 ar 18 8 11 ar 19 8 17 ar 20 9 10 ar 21 9 12 ar 22 9 18 ar 23 10 15 1 24 10 16 ar 25 11 19 ar 26 12 20 ar 27 13 21 ar 28 13 22 ar 29 14 27 1 30 16 29 1 31 17 23 ar 32 17 31 1 33 18 24 ar 34 18 32 1 35 19 25 ar 36 19 33 1 37 20 26 ar 38 20 34 1 39 21 35 1 40 22 36 1 41 23 25 ar 42 24 26 ar 43 25 37 1 44 26 38 1