@MOLECULE methyl [3-(aminomethyl)-4-(2,4-dichlorophenyl)-2-methyl-7-oxo-5,7-dihydro-6h-pyrrolo[3,4-b]pyridin-6-yl]acetate 43 45 0 0 0 SMALL GASTEIGER @ATOM 1 C -2.1240 -0.4570 1.4096 C.ar 1 UNL1111111111 -0.0543 2 C -3.1425 -1.4088 1.4370 C.ar 1 UNL1111111111 -0.1832 3 C -3.2884 -1.3379 -1.0003 C.ar 1 UNL1111111111 -0.2040 4 C -1.6751 0.0515 0.1877 C.ar 1 UNL1111111111 -0.0641 5 C -0.5991 1.0457 0.1390 C.ar 1 UNL1111111111 0.0406 6 C 0.6817 0.6710 -0.2304 C.ar 1 UNL1111111111 -0.0956 7 C -0.8266 2.3991 0.4402 C.ar 1 UNL1111111111 -0.0876 8 C -3.6998 -1.8267 0.2346 C.ar 1 UNL1111111111 0.0465 9 C -2.2680 -0.3971 -0.9912 C.ar 1 UNL1111111111 0.0281 10 C 1.6900 1.6599 -0.2874 C.ar 1 UNL1111111111 0.0557 11 C 0.2411 3.3149 0.3511 C.ar 1 UNL1111111111 0.1875 12 C 2.9837 1.0121 -0.6890 C.2 1 UNL1111111111 0.5756 13 C 3.9398 -1.9311 0.3505 C.2 1 UNL1111111111 0.5642 14 C 1.2550 -0.6630 -0.6099 C.3 1 UNL1111111111 -0.0716 15 C 0.0765 4.7713 0.6380 C.3 1 UNL1111111111 -0.4465 16 C 5.5961 -3.0904 1.5680 C.3 1 UNL1111111111 -0.1669 17 C -2.1967 2.8435 0.8700 C.3 1 UNL1111111111 -0.1040 18 C 3.6582 -1.3579 -1.0300 C.3 1 UNL1111111111 -0.1309 19 N 1.4956 2.9446 -0.0106 N.ar 1 UNL1111111111 -0.3131 20 N 2.6481 -0.3250 -1.0097 N.am 1 UNL1111111111 -0.4941 21 N -2.3572 2.5543 2.3174 N.3 1 UNL1111111111 -0.6392 22 O 4.0925 1.4562 -0.7972 O.2 1 UNL1111111111 -0.4307 23 O 3.2251 -1.9130 1.3165 O.2 1 UNL1111111111 -0.4995 24 O 5.1581 -2.5213 0.3370 O.3 1 UNL1111111111 -0.4087 25 CL -4.9512 -2.9901 0.2703 Cl 1 UNL1111111111 -0.0760 26 CL -1.7166 0.2483 -2.4694 Cl 1 UNL1111111111 -0.0561 27 H -1.6864 -0.0838 2.3419 H 1 UNL1111111111 0.1909 28 H -3.4932 -1.8054 2.3905 H 1 UNL1111111111 0.1793 29 H -3.7457 -1.6754 -1.9312 H 1 UNL1111111111 0.1892 30 H 1.2242 -1.3829 0.2421 H 1 UNL1111111111 0.1809 31 H 0.7295 -1.1252 -1.4750 H 1 UNL1111111111 0.1704 32 H -0.3685 4.9516 1.6242 H 1 UNL1111111111 0.1553 33 H 1.0510 5.2962 0.6242 H 1 UNL1111111111 0.1898 34 H -0.5508 5.2602 -0.1222 H 1 UNL1111111111 0.1655 35 H 5.7273 -2.2997 2.3152 H 1 UNL1111111111 0.1441 36 H 4.8791 -3.8376 1.9231 H 1 UNL1111111111 0.1397 37 H 6.5541 -3.5500 1.2980 H 1 UNL1111111111 0.1486 38 H -2.3715 3.9127 0.6168 H 1 UNL1111111111 0.1248 39 H -2.9848 2.2694 0.3228 H 1 UNL1111111111 0.1597 40 H 4.6048 -0.9326 -1.4666 H 1 UNL1111111111 0.2056 41 H 3.3422 -2.1859 -1.7122 H 1 UNL1111111111 0.1790 42 H -1.6026 2.9472 2.8575 H 1 UNL1111111111 0.2523 43 H -3.2330 2.9069 2.6685 H 1 UNL1111111111 0.2526 @BOND 1 1 2 ar 2 1 27 1 3 2 8 ar 4 2 28 1 5 3 8 ar 6 3 29 1 7 4 1 ar 8 4 9 ar 9 5 4 1 10 6 5 ar 11 6 14 1 12 7 5 ar 13 7 17 1 14 8 25 1 15 9 3 ar 16 10 6 ar 17 11 7 ar 18 12 10 1 19 12 20 am 20 13 18 1 21 14 30 1 22 14 31 1 23 15 11 1 24 15 32 1 25 15 33 1 26 15 34 1 27 16 24 1 28 16 35 1 29 16 36 1 30 16 37 1 31 17 21 1 32 17 38 1 33 17 39 1 34 18 20 1 35 18 40 1 36 18 41 1 37 19 10 ar 38 19 11 ar 39 20 14 1 40 21 42 1 41 21 43 1 42 22 12 2 43 23 13 2 44 24 13 1 45 26 9 1