@MOLECULE 2-deoxy-2-(propionylamino)-d-mannose 33 32 0 0 0 SMALL GASTEIGER @ATOM 1 O 0.0817 2.3778 -1.2040 O.3 1 UNL1111111111 -0.5768 2 O 2.4985 1.2872 -1.1433 O.3 1 UNL1111111111 -0.5765 3 O 3.3258 -0.1718 1.0937 O.3 1 UNL1111111111 -0.5838 4 O 1.6081 -2.6899 0.0261 O.3 1 UNL1111111111 -0.5726 5 O -2.6397 2.6641 0.5637 O.2 1 UNL1111111111 -0.4350 6 O -0.6405 -1.5568 0.9894 O.2 1 UNL1111111111 -0.6205 7 N -1.8869 0.1346 0.2169 N.am 1 UNL1111111111 -0.5769 8 C 0.2453 1.1262 -0.5698 C.3 1 UNL1111111111 0.1090 9 C 1.6835 1.0231 -0.0136 C.3 1 UNL1111111111 0.0635 10 CA -0.8384 1.0993 0.5449 C.3 1 UNL1111111111 -0.0725 11 C 2.0259 -0.3668 0.5543 C.3 1 UNL1111111111 0.0469 12 C 2.0721 -1.4745 -0.5104 C.3 1 UNL1111111111 -0.0369 13 C -1.4545 2.4994 0.6884 C.2 1 UNL1111111111 0.3700 14 C -1.6782 -1.2029 0.4495 C.2 1 UNL1111111111 0.6185 15 C -2.7624 -2.1602 0.0244 C.3 1 UNL1111111111 -0.3392 16 C -2.6119 -2.4728 -1.4611 C.3 1 UNL1111111111 -0.4259 17 H 0.0583 0.3406 -1.3381 H 1 UNL1111111111 0.1500 18 H 1.8901 1.8167 0.7413 H 1 UNL1111111111 0.1471 19 HA -0.3716 0.8103 1.5300 H 1 UNL1111111111 0.1853 20 H 1.3442 -0.6468 1.3938 H 1 UNL1111111111 0.1642 21 H 3.1097 -1.7032 -0.8213 H 1 UNL1111111111 0.1519 22 H 1.4811 -1.2257 -1.4090 H 1 UNL1111111111 0.1266 23 H -2.7218 0.5034 -0.2210 H 1 UNL1111111111 0.3371 24 H -0.7620 3.3151 0.9185 H 1 UNL1111111111 0.1371 25 H 0.8745 2.5878 -1.7526 H 1 UNL1111111111 0.3566 26 H 3.4401 1.1195 -0.9085 H 1 UNL1111111111 0.3500 27 H 3.6696 -1.0154 1.4555 H 1 UNL1111111111 0.3378 28 H -2.6698 -3.0934 0.6252 H 1 UNL1111111111 0.1822 29 H -3.7717 -1.7624 0.2477 H 1 UNL1111111111 0.1644 30 H 0.7086 -2.5687 0.4125 H 1 UNL1111111111 0.3507 31 H -1.6226 -2.8968 -1.6859 H 1 UNL1111111111 0.1620 32 H -3.3569 -3.2104 -1.7869 H 1 UNL1111111111 0.1558 33 H -2.7402 -1.5814 -2.0868 H 1 UNL1111111111 0.1499 @BOND 1 1 8 1 2 1 25 1 3 2 9 1 4 2 26 1 5 3 11 1 6 3 27 1 7 4 12 1 8 4 30 1 9 5 13 2 10 6 14 2 11 7 10 1 12 7 14 am 13 7 23 1 14 8 9 1 15 8 10 1 16 8 17 1 17 9 11 1 18 9 18 1 19 10 13 1 20 10 19 1 21 11 12 1 22 11 20 1 23 12 21 1 24 12 22 1 25 13 24 1 26 14 15 1 27 15 16 1 28 15 28 1 29 15 29 1 30 16 31 1 31 16 32 1 32 16 33 1