@MOLECULE 1,4-dideoxy-1,4-iminoribitol 20 20 0 0 0 SMALL GASTEIGER @ATOM 1 O 3.1604 0.0079 0.0081 O.3 1 UNL1111111111 -0.5398 2 C 1.9856 -0.4409 -0.6282 C.3 1 UNL1111111111 -0.0057 3 CA 0.7758 -0.2860 0.3172 C.3 1 UNL1111111111 -0.0612 4 N 0.6003 1.1647 0.5933 N.3 1 UNL1111111111 -0.5456 5 C -0.5190 -0.8298 -0.3365 C.3 1 UNL1111111111 0.1083 6 O -1.0923 -1.7349 0.5674 O.3 1 UNL1111111111 -0.5450 7 C -1.3894 0.4220 -0.6393 C.3 1 UNL1111111111 0.0750 8 O -2.6773 0.1516 -0.1290 O.3 1 UNL1111111111 -0.5698 9 C -0.7279 1.6039 0.0969 C.3 1 UNL1111111111 -0.1731 10 H 3.0462 0.9467 0.2751 H 1 UNL1111111111 0.3250 11 H1 1.8480 0.1269 -1.5642 H 1 UNL1111111111 0.1205 12 H2 2.2007 -1.5012 -0.8498 H 1 UNL1111111111 0.1417 13 HA 0.9803 -0.8544 1.2610 H 1 UNL1111111111 0.1672 14 H 0.6980 1.3610 1.5899 H 1 UNL1111111111 0.2606 15 H -0.3294 -1.4324 -1.2509 H 1 UNL1111111111 0.1438 16 H -1.9562 -1.4051 0.9057 H 1 UNL1111111111 0.3448 17 H -1.4893 0.6019 -1.7285 H 1 UNL1111111111 0.1320 18 H -3.2324 0.9550 -0.1256 H 1 UNL1111111111 0.3313 19 H -0.5533 2.4664 -0.5818 H 1 UNL1111111111 0.1544 20 H -1.3773 1.9651 0.9161 H 1 UNL1111111111 0.1355 @BOND 1 1 2 1 2 1 10 1 3 2 3 1 4 2 11 1 5 2 12 1 6 3 4 1 7 3 5 1 8 3 13 1 9 4 9 1 10 4 14 1 11 5 6 1 12 5 7 1 13 5 15 1 14 6 16 1 15 7 8 1 16 7 9 1 17 7 17 1 18 8 18 1 19 9 19 1 20 9 20 1