@MOLECULE ethyl 2-(1-piperidinyl)ethyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydro-3,5-pyridinedicarboxylate 64 66 0 0 0 SMALL USER_CHARGES @ATOM 1 O -1.8198 2.9941 -0.3694 O.3 1 UNL11 -0.4326 2 O -0.9655 1.6589 -1.9667 O.2 1 UNL11 -0.5377 3 O 3.5882 0.1107 -1.1896 O.3 1 UNL11 -0.4214 4 O 4.7071 0.4147 0.7350 O.2 1 UNL11 -0.5561 5 O -0.6414 -4.6802 0.8664 O.2 1 UNL11 -0.4145 6 O -0.1270 -3.1602 2.2955 O.2 1 UNL11 -0.4180 7 N -3.5511 0.8692 -0.2405 N.3 1 UNL11 -0.4287 8 N 0.9568 1.6395 2.4038 N.pl3 1 UNL11 -0.4804 9 N -0.2460 -3.5583 1.1457 N.pl3 1 UNL11 0.6282 10 C -4.2006 0.1481 0.8830 C.3 1 UNL11 -0.1072 11 C -3.6710 0.0962 -1.5019 C.3 1 UNL11 -0.1134 12 C -3.4715 -1.1916 1.1006 C.3 1 UNL11 -0.2712 13 C -2.9648 -1.2608 -1.3403 C.3 1 UNL11 -0.2785 14 C -3.5576 -2.0464 -0.1679 C.3 1 UNL11 -0.2638 15 C -4.0989 2.2360 -0.3947 C.3 1 UNL11 -0.1606 16 C 1.2305 0.9426 -0.3594 C.3 1 UNL11 -0.0151 17 C -3.0384 3.1202 -1.0885 C.3 1 UNL11 -0.0215 18 C 0.0520 1.7013 0.1893 C.2 1 UNL11 -0.3143 19 C 2.3676 0.8996 0.6200 C.2 1 UNL11 -0.3372 20 C -0.0820 1.9523 1.5162 C.2 1 UNL11 0.3317 21 C 0.7889 -0.4722 -0.6711 C.ar 1 UNL11 0.0009 22 C 2.1947 1.2021 1.9365 C.2 1 UNL11 0.3331 23 C -0.9383 2.0526 -0.8246 C.2 1 UNL11 0.6719 24 C -1.2841 2.5478 2.1588 C.3 1 UNL11 -0.4865 25 C 0.4799 -1.3483 0.3681 C.ar 1 UNL11 -0.1002 26 C 3.6665 0.4741 0.1184 C.2 1 UNL11 0.6385 27 C 0.6843 -0.8994 -1.9967 C.ar 1 UNL11 -0.0722 28 C 3.2649 1.0862 2.9626 C.3 1 UNL11 -0.4871 29 C 0.0906 -2.6536 0.0625 C.ar 1 UNL11 -0.0814 30 C 0.3044 -2.2105 -2.2865 C.ar 1 UNL11 -0.1716 31 C 0.0076 -3.1006 -1.2595 C.ar 1 UNL11 -0.0995 32 C 4.7974 -0.3148 -1.8182 C.3 1 UNL11 0.0102 33 C 5.6148 0.9004 -2.2251 C.3 1 UNL11 -0.4813 34 H -5.2820 -0.0318 0.7075 H 1 UNL11 0.1121 35 H -4.1147 0.7697 1.7990 H 1 UNL11 0.1232 36 H -3.1621 0.6734 -2.3086 H 1 UNL11 0.1521 37 H -4.7262 -0.0541 -1.8099 H 1 UNL11 0.1066 38 H -3.9063 -1.7240 1.9639 H 1 UNL11 0.1370 39 H -2.4096 -0.9982 1.3512 H 1 UNL11 0.1509 40 H -1.8832 -1.0802 -1.1663 H 1 UNL11 0.1625 41 H -3.0382 -1.8349 -2.2793 H 1 UNL11 0.1326 42 H -3.0150 -3.0002 -0.0284 H 1 UNL11 0.1413 43 H -4.6071 -2.3210 -0.3777 H 1 UNL11 0.1333 44 H -5.0477 2.2719 -0.9695 H 1 UNL11 0.1218 45 H -4.3155 2.6590 0.6100 H 1 UNL11 0.1391 46 H 1.5791 1.4462 -1.3069 H 1 UNL11 0.1777 47 H -2.9026 2.8602 -2.1534 H 1 UNL11 0.1503 48 H -3.2786 4.1936 -0.9937 H 1 UNL11 0.1326 49 H 0.8353 1.8250 3.3896 H 1 UNL11 0.3181 50 H -2.2065 2.0850 1.7432 H 1 UNL11 0.2117 51 H -1.3669 3.6241 1.9274 H 1 UNL11 0.1880 52 H -1.3270 2.4297 3.2469 H 1 UNL11 0.1544 53 H 0.5385 -1.0170 1.4083 H 1 UNL11 0.1832 54 H 0.8896 -0.1977 -2.8090 H 1 UNL11 0.1714 55 H 4.1356 1.7198 2.6999 H 1 UNL11 0.2006 56 H 3.6785 0.0576 2.9876 H 1 UNL11 0.2026 57 H 2.9602 1.3448 3.9819 H 1 UNL11 0.1549 58 H 0.2351 -2.5359 -3.3230 H 1 UNL11 0.1569 59 H -0.2909 -4.1284 -1.4769 H 1 UNL11 0.1760 60 H 5.3544 -0.9917 -1.1454 H 1 UNL11 0.1391 61 H 4.4058 -0.8793 -2.6851 H 1 UNL11 0.1351 62 H 6.4854 0.6165 -2.8250 H 1 UNL11 0.1491 63 H 5.9828 1.4384 -1.3393 H 1 UNL11 0.1669 64 H 5.0143 1.6080 -2.8098 H 1 UNL11 0.1568 @BOND 1 58 30 1 2 62 33 1 3 64 33 1 4 54 27 1 5 61 32 1 6 36 11 1 7 30 27 ar 8 30 31 ar 9 41 13 1 10 33 32 1 11 33 63 1 12 47 17 1 13 27 21 ar 14 2 23 2 15 32 3 1 16 32 60 1 17 37 11 1 18 11 13 1 19 11 7 1 20 59 31 1 21 13 40 1 22 13 14 1 23 46 16 1 24 31 29 ar 25 3 26 1 26 17 48 1 27 17 15 1 28 17 1 1 29 44 15 1 30 23 1 1 31 23 18 1 32 21 16 1 33 21 25 ar 34 15 7 1 35 15 45 1 36 43 14 1 37 16 18 1 38 16 19 1 39 7 10 1 40 14 42 1 41 14 12 1 42 29 25 ar 43 29 9 1 44 26 19 1 45 26 4 2 46 18 20 2 47 25 53 1 48 19 22 2 49 34 10 1 50 5 9 2 51 10 12 1 52 10 35 1 53 12 39 1 54 12 38 1 55 9 6 2 56 20 24 1 57 20 8 1 58 50 24 1 59 51 24 1 60 22 8 1 61 22 28 1 62 24 52 1 63 8 49 1 64 55 28 1 65 28 56 1 66 28 57 1