@MOLECULE 1-amino-2,5-anhydro-1-deoxymannitol 24 24 0 0 0 SMALL GASTEIGER @ATOM 1 O -0.1454 -0.8782 -0.4025 O.3 1 UNL1111111111 -0.4369 2 O -0.2790 1.6669 1.7589 O.3 1 UNL1111111111 -0.5462 3 O 0.8842 1.9584 -1.5270 O.3 1 UNL1111111111 -0.5355 4 O 2.1734 -2.2573 0.2862 O.3 1 UNL1111111111 -0.5277 5 N -2.9305 -1.5711 -0.3042 N.3 1 UNL1111111111 -0.6160 6 C -0.4663 1.3531 0.3978 C.3 1 UNL1111111111 0.0478 7 C 0.9094 1.2552 -0.3154 C.3 1 UNL1111111111 0.0601 8 C -1.0268 -0.0817 0.3885 C.3 1 UNL1111111111 0.0295 9 C 1.1245 -0.2509 -0.5312 C.3 1 UNL1111111111 0.0050 10 C -2.4030 -0.1980 -0.2941 C.3 1 UNL1111111111 -0.1325 11 C 2.0694 -0.8680 0.5088 C.3 1 UNL1111111111 -0.0427 12 H -1.1286 2.1037 -0.0746 H 1 UNL1111111111 0.1409 13 H 1.7229 1.7555 0.2503 H 1 UNL1111111111 0.1669 14 H -1.0272 -0.5150 1.4135 H 1 UNL1111111111 0.1562 15 H 1.4418 -0.5066 -1.5664 H 1 UNL1111111111 0.1673 16 H -2.3386 0.1483 -1.3506 H 1 UNL1111111111 0.1535 17 H -3.1366 0.4629 0.2191 H 1 UNL1111111111 0.1526 18 H 1.7166 -0.6984 1.5428 H 1 UNL1111111111 0.1353 19 H 3.1079 -0.5051 0.3992 H 1 UNL1111111111 0.1501 20 H -0.0614 2.6151 1.8741 H 1 UNL1111111111 0.3248 21 H 0.2749 1.5377 -2.1711 H 1 UNL1111111111 0.3219 22 H -3.0822 -1.9234 0.6274 H 1 UNL1111111111 0.2465 23 H -2.3047 -2.1975 -0.7881 H 1 UNL1111111111 0.2572 24 H 1.2731 -2.6361 0.1761 H 1 UNL1111111111 0.3220 @BOND 1 1 8 1 2 1 9 1 3 2 6 1 4 2 20 1 5 3 7 1 6 3 21 1 7 4 11 1 8 4 24 1 9 5 10 1 10 5 22 1 11 5 23 1 12 6 7 1 13 6 8 1 14 6 12 1 15 7 9 1 16 7 13 1 17 8 10 1 18 8 14 1 19 9 11 1 20 9 15 1 21 10 16 1 22 10 17 1 23 11 18 1 24 11 19 1