@MOLECULE 2-acetamido-2-deoxy-d-mannose 30 29 0 0 0 SMALL GASTEIGER @ATOM 1 O -3.5155 -0.6589 -1.0303 O.2 1 UNL1111111111 -0.6121 2 CA -1.6741 -0.0427 0.3627 C.3 1 UNL1111111111 0.3429 3 N -1.1002 -1.3073 -0.0698 N.am 1 UNL1111111111 -0.1669 4 C -0.0965 -1.9065 0.6622 C.2 1 UNL1111111111 0.7401 5 C -3.0997 0.0888 -0.1840 C.2 1 UNL1111111111 0.1869 6 O 0.2569 -1.4438 1.7325 O.2 1 UNL1111111111 -0.7964 7 C 0.4817 -3.1625 0.0756 C.3 1 UNL1111111111 -0.9824 8 C -0.8805 1.1823 -0.1859 C.3 1 UNL1111111111 0.4386 9 O -1.6368 2.3281 0.1272 O.3 1 UNL1111111111 -0.7070 10 C 0.5332 1.2835 0.4307 C.3 1 UNL1111111111 -0.6071 11 O 0.8036 2.6209 0.7813 O.3 1 UNL1111111111 -0.4350 12 C 1.6351 0.8051 -0.5377 C.3 1 UNL1111111111 0.3494 13 C 2.7896 0.1462 0.2318 C.3 1 UNL1111111111 -0.2054 14 O 3.7319 -0.1705 -0.7840 O.3 1 UNL1111111111 -0.5011 15 O 1.0397 -0.1511 -1.3968 O.3 1 UNL1111111111 -1.1343 16 H -0.2933 -3.8862 -0.2102 H 1 UNL1111111111 0.2724 17 H 1.0875 -2.9401 -0.8147 H 1 UNL1111111111 0.3280 18 H 1.1390 -3.6571 0.8083 H 1 UNL1111111111 0.2768 19 H -1.3304 -1.6035 -1.0099 H 1 UNL1111111111 0.3609 20 HA -1.6942 -0.0063 1.4875 H 1 UNL1111111111 0.1058 21 H -0.8589 1.1818 -1.3009 H 1 UNL1111111111 0.1617 22 H -1.3957 2.6888 1.0124 H 1 UNL1111111111 0.3626 23 H 0.5902 0.7655 1.4221 H 1 UNL1111111111 0.4185 24 H 0.6666 3.2283 0.0195 H 1 UNL1111111111 0.3406 25 H 2.0082 1.6420 -1.1731 H 1 UNL1111111111 0.0910 26 H 1.7459 -0.5731 -1.9383 H 1 UNL1111111111 0.6000 27 H 3.2428 0.8378 0.9628 H 1 UNL1111111111 0.0928 28 H 2.4710 -0.7864 0.7360 H 1 UNL1111111111 0.1877 29 H 4.5314 -0.5717 -0.3949 H 1 UNL1111111111 0.3587 30 H -3.7031 0.9074 0.2236 H 1 UNL1111111111 0.1324 @BOND 1 2 5 1 2 2 8 1 3 2 20 1 4 3 2 1 5 3 19 1 6 4 6 2 7 4 3 am 8 5 1 2 9 5 30 1 10 7 4 1 11 7 16 1 12 7 17 1 13 7 18 1 14 8 9 1 15 8 10 1 16 8 21 1 17 9 22 1 18 10 11 1 19 10 12 1 20 10 23 1 21 11 24 1 22 12 15 1 23 12 13 1 24 12 25 1 25 13 14 1 26 13 27 1 27 13 28 1 28 14 29 1 29 15 26 1