@MOLECULE ethyl 2-methyl-5-[(1r,2s,3r)-1,2,3,4-tetrahydroxybutyl]-1h-pyrrole-3-carboxylate 38 38 0 0 0 SMALL GASTEIGER @ATOM 1 O -1.7140 -0.0905 2.0126 O.3 1 UNL111111111 -0.5097 2 O -1.8042 1.3015 -0.3944 O.3 1 UNL111111111 -0.5552 3 O -4.4416 -1.0582 -0.5116 O.3 1 UNL111111111 -0.5604 4 O -5.7804 1.4372 -0.3276 O.3 1 UNL111111111 -0.5426 5 O 3.3163 1.2687 -0.0060 O.3 1 UNL111111111 -0.4244 6 O 4.4189 -0.6296 -0.4731 O.2 1 UNL111111111 -0.5422 7 N 0.4208 -2.1938 0.1114 N.ar 1 UNL111111111 -0.3304 8 C -1.5627 -0.7864 0.8018 C.3 1 UNL111111111 0.1017 9 C -2.2878 -0.0233 -0.3388 C.3 1 UNL111111111 0.0440 10 C -0.1226 -0.9500 0.4666 C.ar 1 UNL111111111 -0.0485 11 C -3.7938 0.1001 -0.0299 C.3 1 UNL111111111 0.0783 12 C 0.8931 -0.0059 0.4260 C.ar 1 UNL111111111 -0.1507 13 C 1.7702 -2.0363 -0.1587 C.ar 1 UNL111111111 0.1986 14 C 2.0841 -0.6809 0.0212 C.ar 1 UNL111111111 -0.2726 15 C -4.4134 1.3485 -0.6668 C.3 1 UNL111111111 -0.0427 16 C 2.6251 -3.1639 -0.5601 C.3 1 UNL111111111 -0.4702 17 C 3.3826 -0.0774 -0.1795 C.2 1 UNL111111111 0.6424 18 C 4.5497 1.9836 -0.1786 C.3 1 UNL111111111 0.0089 19 C 4.1831 3.4259 0.1345 C.3 1 UNL111111111 -0.4612 20 H -2.0739 -1.7589 1.0123 H 1 UNL111111111 0.1635 21 H -2.1173 -0.5189 -1.3186 H 1 UNL111111111 0.1294 22 H -4.0048 0.0553 1.0676 H 1 UNL111111111 0.1838 23 H -0.0809 -3.0534 0.0930 H 1 UNL111111111 0.3125 24 H 0.8360 1.0372 0.6678 H 1 UNL111111111 0.1740 25 H -3.9747 2.2840 -0.2645 H 1 UNL111111111 0.1693 26 H -4.3267 1.3510 -1.7668 H 1 UNL111111111 0.1217 27 H -1.4501 0.8535 1.8950 H 1 UNL111111111 0.3289 28 H -0.8622 1.3130 -0.6802 H 1 UNL111111111 0.3334 29 H 2.2855 -3.6458 -1.4889 H 1 UNL111111111 0.1670 30 H 3.6663 -2.8206 -0.7477 H 1 UNL111111111 0.2104 31 H 2.6949 -3.9380 0.2198 H 1 UNL111111111 0.1710 32 H -4.4519 -1.0899 -1.4888 H 1 UNL111111111 0.3144 33 H -6.1910 0.5455 -0.3335 H 1 UNL111111111 0.3225 34 H 5.3009 1.5679 0.5157 H 1 UNL111111111 0.1350 35 H 4.8919 1.8396 -1.2181 H 1 UNL111111111 0.1315 36 H 5.0466 4.0883 0.0112 H 1 UNL111111111 0.1508 37 H 3.3820 3.7848 -0.5248 H 1 UNL111111111 0.1582 38 H 3.8196 3.5288 1.1656 H 1 UNL111111111 0.1598 @BOND 1 1 8 1 2 1 27 1 3 2 9 1 4 2 28 1 5 3 11 1 6 3 32 1 7 4 15 1 8 4 33 1 9 5 17 1 10 5 18 1 11 6 17 2 12 7 10 ar 13 7 13 ar 14 7 23 1 15 8 9 1 16 8 10 1 17 8 20 1 18 9 11 1 19 9 21 1 20 10 12 ar 21 11 15 1 22 11 22 1 23 12 14 ar 24 12 24 1 25 13 14 ar 26 13 16 1 27 14 17 1 28 15 25 1 29 15 26 1 30 16 29 1 31 16 30 1 32 16 31 1 33 18 19 1 34 18 34 1 35 18 35 1 36 19 36 1 37 19 37 1 38 19 38 1