@MOLECULE 2-[(2r,5s)-5-(hydroxymethyl)-2,5-dihydro-2-furanyl]-1,3-thiazole-4-carboxamide 25 26 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 S -1.2242 2.4407 -0.0067 S.2 1 UNL1 0.1847 2 O 2.1352 0.6623 -1.1099 O.3 1 UNL1 -0.3848 3 O 1.7268 -2.4062 0.4055 O.3 1 UNL1 -0.5332 4 O -3.7372 -1.4403 -0.0563 O.2 1 UNL1 -0.5280 5 N -0.4424 -0.0166 -0.0795 N.ar 1 UNL1 -0.3466 6 N -1.7340 -2.4588 0.1903 N.am 1 UNL1 -0.6537 7 C 1.5226 1.4740 -0.1022 C.3 1 UNL1 0.1129 8 C 2.8428 -0.4231 -0.4780 C.3 1 UNL1 0.0530 9 C 2.1486 1.0293 1.2042 C.2 1 UNL1 -0.2037 10 C 2.8832 -0.0678 0.9865 C.2 1 UNL1 -0.1336 11 C 0.0528 1.1924 -0.0776 C.ar 1 UNL1 0.0333 12 C 2.0776 -1.7241 -0.7779 C.3 1 UNL1 -0.0361 13 C -1.8357 -0.0320 -0.0097 C.ar 1 UNL1 -0.0118 14 C -2.4362 1.1967 0.0341 C.ar 1 UNL1 -0.2510 15 C -2.5268 -1.3497 0.0310 C.2 1 UNL1 0.6008 16 H 1.7729 2.5158 -0.3998 H 1 UNL1 0.1590 17 H 3.8414 -0.3967 -0.9630 H 1 UNL1 0.1434 18 H 1.9588 1.5506 2.1209 H 1 UNL1 0.1670 19 H 3.4313 -0.6612 1.6925 H 1 UNL1 0.1607 20 H 2.6387 -2.3921 -1.4496 H 1 UNL1 0.1157 21 H 1.0882 -1.4865 -1.2325 H 1 UNL1 0.1865 22 H -3.4974 1.3926 0.0864 H 1 UNL1 0.2095 23 H 2.4880 -2.8993 0.7652 H 1 UNL1 0.3047 24 H -0.7300 -2.3844 0.2466 H 1 UNL1 0.3376 25 H -2.1415 -3.3703 0.2215 H 1 UNL1 0.3136 @BOND 1 20 12 1 2 21 12 1 3 2 8 1 4 2 7 1 5 17 8 1 6 12 8 1 7 12 3 1 8 8 10 1 9 16 7 1 10 7 11 1 11 7 9 1 12 5 11 ar 13 5 13 ar 14 11 1 ar 15 4 15 2 16 13 15 1 17 13 14 ar 18 1 14 ar 19 15 6 am 20 14 22 1 21 6 25 1 22 6 24 1 23 3 23 1 24 10 9 2 25 10 19 1 26 9 18 1