@MOLECULE 3-(diethylamino)-1-phenyl-1-propanone o-(((4-methoxyphenyl)amino)carbonyl)oxime 54 55 0 0 0 SMALL GASTEIGER @ATOM 1 O -0.2049 -0.2738 -0.1230 O.3 1 UNL1111111111 -0.2757 2 O 7.4835 0.0289 0.2672 O.3 1 UNL1111111111 -0.3159 3 O 1.3264 -1.9802 -0.5014 O.2 1 UNL1111111111 -0.4550 4 N -2.9872 2.8469 -0.2898 N.3 1 UNL1111111111 -0.4428 5 N -1.1611 -1.2718 0.0807 N.2 1 UNL1111111111 -0.1602 6 N 1.9468 0.1722 0.1474 N.am 1 UNL1111111111 -0.5636 7 C -2.5780 1.5521 0.2992 C.3 1 UNL1111111111 -0.0946 8 C -2.6790 0.4799 -0.8099 C.3 1 UNL1111111111 -0.3161 9 C -3.6901 3.7028 0.6849 C.3 1 UNL1111111111 -0.0848 10 C -1.8479 3.5287 -0.9504 C.3 1 UNL1111111111 -0.0853 11 C -2.3494 -0.8698 -0.2453 C.2 1 UNL1111111111 0.1249 12 C -2.8897 4.1008 1.9336 C.3 1 UNL1111111111 -0.4879 13 C -2.3758 4.5581 -1.9582 C.3 1 UNL1111111111 -0.4472 14 C -3.4516 -1.8307 -0.0382 C.ar 1 UNL1111111111 -0.0333 15 C -4.6679 -1.3943 0.4926 C.ar 1 UNL1111111111 -0.1342 16 C -3.2771 -3.1753 -0.3766 C.ar 1 UNL1111111111 -0.1096 17 C -5.7084 -2.3014 0.6776 C.ar 1 UNL1111111111 -0.1557 18 C -4.3221 -4.0777 -0.1923 C.ar 1 UNL1111111111 -0.1571 19 C -5.5369 -3.6420 0.3333 C.ar 1 UNL1111111111 -0.1327 20 C 1.0731 -0.8555 -0.1752 C.2 1 UNL1111111111 0.7040 21 C 3.3572 0.0453 0.1422 C.ar 1 UNL1111111111 0.1592 22 C 4.0958 1.1594 0.5902 C.ar 1 UNL1111111111 -0.1832 23 C 4.0155 -1.1134 -0.2782 C.ar 1 UNL1111111111 -0.1540 24 C 6.1269 -0.0637 0.1896 C.ar 1 UNL1111111111 0.2042 25 C 5.4783 1.1073 0.6148 C.ar 1 UNL1111111111 -0.1994 26 C 5.4074 -1.1697 -0.2555 C.ar 1 UNL1111111111 -0.2457 27 C 8.2304 -1.1113 -0.1317 C.3 1 UNL1111111111 -0.2025 28 H -1.5537 1.5716 0.7274 H 1 UNL1111111111 0.1262 29 H -3.2603 1.2810 1.1341 H 1 UNL1111111111 0.1382 30 H -3.6922 0.5080 -1.2620 H 1 UNL1111111111 0.1771 31 H -1.9911 0.7266 -1.6470 H 1 UNL1111111111 0.1731 32 H -4.0292 4.6167 0.1471 H 1 UNL1111111111 0.1401 33 H -4.6191 3.1660 0.9851 H 1 UNL1111111111 0.1378 34 H -1.1611 4.0168 -0.2268 H 1 UNL1111111111 0.1107 35 H -1.2483 2.7645 -1.4951 H 1 UNL1111111111 0.1349 36 H -2.5528 3.2245 2.4965 H 1 UNL1111111111 0.1489 37 H -2.0037 4.6897 1.6741 H 1 UNL1111111111 0.1471 38 H -3.4996 4.7105 2.6087 H 1 UNL1111111111 0.1489 39 H -2.7744 5.4484 -1.4628 H 1 UNL1111111111 0.1408 40 H -3.1881 4.1277 -2.5601 H 1 UNL1111111111 0.1625 41 H -1.5836 4.8792 -2.6415 H 1 UNL1111111111 0.1422 42 H -4.8063 -0.3484 0.7640 H 1 UNL1111111111 0.1570 43 H -2.3189 -3.5162 -0.7762 H 1 UNL1111111111 0.1743 44 H -6.6559 -1.9635 1.0921 H 1 UNL1111111111 0.1505 45 H -4.1864 -5.1249 -0.4566 H 1 UNL1111111111 0.1534 46 H -6.3521 -4.3483 0.4768 H 1 UNL1111111111 0.1474 47 H 1.5642 1.0697 0.4269 H 1 UNL1111111111 0.3226 48 H 3.5852 2.0620 0.9212 H 1 UNL1111111111 0.1588 49 H 3.4544 -1.9851 -0.6271 H 1 UNL1111111111 0.1960 50 H 6.0700 1.9543 0.9559 H 1 UNL1111111111 0.1708 51 H 5.9079 -2.0754 -0.5853 H 1 UNL1111111111 0.1646 52 H 8.0027 -1.9720 0.5048 H 1 UNL1111111111 0.1350 53 H 8.0636 -1.3375 -1.1894 H 1 UNL1111111111 0.1343 54 H 9.2650 -0.7781 0.0302 H 1 UNL1111111111 0.1510 @BOND 1 1 5 1 2 1 20 1 3 2 24 1 4 2 27 1 5 3 20 2 6 4 7 1 7 4 9 1 8 4 10 1 9 5 11 2 10 6 20 am 11 6 21 1 12 6 47 1 13 7 8 1 14 7 28 1 15 7 29 1 16 8 11 1 17 8 30 1 18 8 31 1 19 9 12 1 20 9 32 1 21 9 33 1 22 10 13 1 23 10 34 1 24 10 35 1 25 11 14 1 26 12 36 1 27 12 37 1 28 12 38 1 29 13 39 1 30 13 40 1 31 13 41 1 32 14 15 ar 33 14 16 ar 34 15 17 ar 35 15 42 1 36 16 18 ar 37 16 43 1 38 17 19 ar 39 17 44 1 40 18 19 ar 41 18 45 1 42 19 46 1 43 21 22 ar 44 21 23 ar 45 22 25 ar 46 22 48 1 47 23 26 ar 48 23 49 1 49 24 25 ar 50 24 26 ar 51 25 50 1 52 26 51 1 53 27 52 1 54 27 53 1 55 27 54 1