@MOLECULE ethyl 4-methyl-2-(methylsulfanyl)-5-pyrimidinecarboxylate 26 26 0 0 0 SMALL GASTEIGER @ATOM 1 S -3.6610 -1.0221 0.0040 S.3 1 UNL1111111111 0.1970 2 O 2.8297 -0.5163 -0.0075 O.3 1 UNL1111111111 -0.4364 3 O 2.5049 1.7036 0.0029 O.2 1 UNL1111111111 -0.5145 4 N -1.6859 0.8189 -0.0011 N.ar 1 UNL1111111111 -0.5137 5 N -1.0535 -1.4997 -0.0088 N.ar 1 UNL1111111111 -0.4573 6 C 0.6319 0.2103 -0.0071 C.ar 1 UNL1111111111 -0.3935 7 C -0.3852 1.1912 -0.0034 C.ar 1 UNL1111111111 0.3684 8 C 2.0426 0.5882 -0.0038 C.2 1 UNL1111111111 0.6377 9 C 0.2379 -1.1422 -0.0108 C.ar 1 UNL1111111111 0.1946 10 C -0.1026 2.6465 -0.0011 C.3 1 UNL1111111111 -0.4630 11 C 4.2484 -0.2796 0.0075 C.3 1 UNL1111111111 0.0187 12 C -1.9773 -0.5018 -0.0029 C.ar 1 UNL1111111111 0.2849 13 C 4.8482 -1.6757 0.0119 C.3 1 UNL1111111111 -0.4621 14 C -4.5756 0.5437 0.0100 C.3 1 UNL1111111111 -0.5085 15 H 0.9725 -1.9644 -0.0150 H 1 UNL1111111111 0.1994 16 H -1.0186 3.2587 -0.0001 H 1 UNL1111111111 0.1806 17 H 0.5013 2.9382 0.8784 H 1 UNL1111111111 0.1945 18 H 0.5015 2.9409 -0.8794 H 1 UNL1111111111 0.1944 19 H 4.5135 0.3046 -0.8911 H 1 UNL1111111111 0.1350 20 H 4.4956 0.3024 0.9126 H 1 UNL1111111111 0.1350 21 H 5.9429 -1.6343 0.0323 H 1 UNL1111111111 0.1521 22 H 4.5153 -2.2510 0.8863 H 1 UNL1111111111 0.1609 23 H 4.5475 -2.2432 -0.8790 H 1 UNL1111111111 0.1606 24 H -4.3524 1.1574 -0.8733 H 1 UNL1111111111 0.1809 25 H -4.3382 1.1591 0.8885 H 1 UNL1111111111 0.1811 26 H -5.6488 0.3203 0.0190 H 1 UNL1111111111 0.1730 @BOND 1 1 12 1 2 1 14 1 3 2 8 1 4 2 11 1 5 3 8 2 6 4 7 ar 7 4 12 ar 8 5 9 ar 9 5 12 ar 10 6 7 ar 11 6 8 1 12 6 9 ar 13 7 10 1 14 9 15 1 15 10 16 1 16 10 17 1 17 10 18 1 18 11 13 1 19 11 19 1 20 11 20 1 21 13 21 1 22 13 22 1 23 13 23 1 24 14 24 1 25 14 25 1 26 14 26 1