@MOLECULE 6-{[4-(4-chlorophenyl)-3,6-dihydro-1(2h)-pyridinyl]methyl}-2-methyl-2h-1,4-benzoxazin-3(4h)-one 47 50 0 0 0 SMALL GASTEIGER @ATOM 1 C 7.4146 -0.1073 -1.2571 C.3 1 UNL1111111111 -0.4820 2 C 6.6809 -1.2154 -0.5184 C.3 1 UNL1111111111 0.0523 3 O 5.4089 -1.4474 -1.1071 O.3 1 UNL1111111111 -0.3177 4 C 4.4308 -0.5554 -0.7680 C.ar 1 UNL1111111111 0.1318 5 C 3.4132 -0.3500 -1.6929 C.ar 1 UNL1111111111 -0.1752 6 C 2.3553 0.4864 -1.3466 C.ar 1 UNL1111111111 -0.1442 7 C 2.3204 1.1069 -0.0959 C.ar 1 UNL1111111111 0.0004 8 C 1.1881 2.0398 0.2468 C.3 1 UNL1111111111 -0.1307 9 N -0.1133 1.4382 -0.1447 N.3 1 UNL1111111111 -0.4149 10 C -1.2054 2.4288 0.0108 C.3 1 UNL1111111111 -0.1078 11 C -2.4928 1.8245 -0.5812 C.3 1 UNL1111111111 -0.2771 12 C -2.7821 0.5064 0.0642 C.2 1 UNL1111111111 -0.0222 13 C -1.8075 -0.2300 0.6103 C.2 1 UNL1111111111 -0.1838 14 C -0.3747 0.2024 0.6400 C.3 1 UNL1111111111 -0.1136 15 C -4.1847 0.0770 0.0530 C.ar 1 UNL1111111111 -0.0174 16 C -4.8245 -0.1881 -1.1620 C.ar 1 UNL1111111111 -0.1349 17 C -6.1607 -0.5807 -1.1772 C.ar 1 UNL1111111111 -0.1658 18 C -6.8280 -0.6941 0.0356 C.ar 1 UNL1111111111 0.0215 19 CL -8.4731 -1.1696 0.0231 Cl 1 UNL1111111111 -0.0927 20 C -6.2189 -0.4392 1.2572 C.ar 1 UNL1111111111 -0.1650 21 C -4.8803 -0.0528 1.2591 C.ar 1 UNL1111111111 -0.1365 22 C 3.3405 0.8971 0.8337 C.ar 1 UNL1111111111 -0.2295 23 C 4.4049 0.0574 0.4999 C.ar 1 UNL1111111111 0.1088 24 N 5.4571 -0.2030 1.3960 N.am 1 UNL1111111111 -0.5431 25 C 6.6020 -0.8614 0.9638 C.2 1 UNL1111111111 0.5306 26 O 7.4920 -1.0941 1.7497 O.2 1 UNL1111111111 -0.4896 27 H 8.4348 0.0265 -0.8705 H 1 UNL1111111111 0.1726 28 H 7.4899 -0.3341 -2.3296 H 1 UNL1111111111 0.1696 29 H 6.8951 0.8563 -1.1705 H 1 UNL1111111111 0.1636 30 H 7.1659 -2.2152 -0.6535 H 1 UNL1111111111 0.1807 31 H 3.4509 -0.8418 -2.6629 H 1 UNL1111111111 0.1736 32 H 1.5356 0.6568 -2.0493 H 1 UNL1111111111 0.1803 33 H 1.2191 2.3326 1.3200 H 1 UNL1111111111 0.1239 34 H 1.3189 2.9821 -0.3408 H 1 UNL1111111111 0.1549 35 H -1.3754 2.7250 1.0673 H 1 UNL1111111111 0.1183 36 H -0.9313 3.3466 -0.5522 H 1 UNL1111111111 0.1357 37 H -3.3352 2.5316 -0.4582 H 1 UNL1111111111 0.1491 38 H -2.3655 1.6770 -1.6764 H 1 UNL1111111111 0.1664 39 H -1.9987 -1.1980 1.0693 H 1 UNL1111111111 0.1551 40 H 0.2631 -0.5945 0.1773 H 1 UNL1111111111 0.1655 41 H -0.0458 0.2943 1.7019 H 1 UNL1111111111 0.1285 42 H -4.2729 -0.0925 -2.0968 H 1 UNL1111111111 0.1628 43 H -6.6628 -0.7924 -2.1210 H 1 UNL1111111111 0.1718 44 H -6.7659 -0.5375 2.1943 H 1 UNL1111111111 0.1717 45 H -4.3731 0.1530 2.2011 H 1 UNL1111111111 0.1621 46 H 3.3089 1.3787 1.8075 H 1 UNL1111111111 0.1635 47 H 5.3781 0.0957 2.3601 H 1 UNL1111111111 0.3288 @BOND 1 1 27 1 2 1 28 1 3 1 29 1 4 2 1 1 5 2 25 1 6 2 30 1 7 3 4 1 8 3 2 1 9 4 23 ar 10 5 6 ar 11 5 4 ar 12 5 31 1 13 6 7 ar 14 6 32 1 15 7 8 1 16 7 22 ar 17 8 33 1 18 8 34 1 19 9 14 1 20 9 8 1 21 10 9 1 22 10 35 1 23 10 36 1 24 11 12 1 25 11 10 1 26 11 37 1 27 11 38 1 28 12 13 2 29 13 14 1 30 13 39 1 31 14 40 1 32 14 41 1 33 15 21 ar 34 15 12 1 35 16 15 ar 36 16 42 1 37 17 18 ar 38 17 16 ar 39 17 43 1 40 18 20 ar 41 19 18 1 42 20 21 ar 43 20 44 1 44 21 45 1 45 22 46 1 46 23 22 ar 47 23 24 1 48 24 47 1 49 25 24 am 50 25 26 2