@MOLECULE 3-o-(3,6-anhydro-alpha-d-galactopyranosyl)-d-galactopyranose 42 44 0 0 0 SMALL GASTEIGER @ATOM 1 O 2.1314 -0.8940 1.1451 O.3 1 UNL111111111 -0.4399 2 O 4.4334 1.0961 0.4271 O.3 1 UNL111111111 -0.3977 3 O 0.3542 -0.1175 -0.0015 O.3 1 UNL111111111 -0.4396 4 O -3.6238 -0.8681 0.5833 O.3 1 UNL111111111 -0.4572 5 O 4.3245 -0.7117 -1.7708 O.3 1 UNL111111111 -0.5229 6 O 1.2163 2.2326 -0.5168 O.3 1 UNL111111111 -0.5380 7 O -1.8185 0.9499 -1.2897 O.3 1 UNL111111111 -0.5476 8 O -1.0425 -2.7615 0.7220 O.3 1 UNL111111111 -0.5472 9 O -3.1352 -1.3833 -1.6021 O.3 1 UNL111111111 -0.6198 10 O -4.9224 2.2796 0.6322 O.3 1 UNL111111111 -0.5361 11 C 3.3376 1.1073 -0.4873 C.3 1 UNL111111111 0.0050 12 C 3.2444 -0.3574 -0.9568 C.3 1 UNL111111111 0.0714 13 C 3.3509 -1.0240 0.4431 C.3 1 UNL111111111 0.0395 14 C 2.0698 1.4885 0.3036 C.3 1 UNL111111111 0.0501 15 C 1.3531 0.2548 0.9286 C.3 1 UNL111111111 0.2577 16 C -0.9330 -0.3537 0.5424 C.3 1 UNL111111111 0.0148 17 C 4.3910 -0.1365 1.1551 C.3 1 UNL111111111 -0.1085 18 C -1.8582 0.8018 0.1033 C.3 1 UNL111111111 0.0678 19 C -1.3794 -1.6702 -0.1069 C.3 1 UNL111111111 0.0545 20 C -3.2857 0.5115 0.6101 C.3 1 UNL111111111 0.0179 21 C -2.9139 -1.7298 -0.2463 C.3 1 UNL111111111 0.3478 22 C -4.3545 1.2816 -0.1837 C.3 1 UNL111111111 -0.0333 23 H 3.6014 1.8448 -1.2665 H 1 UNL111111111 0.1803 24 H 2.3433 -0.6344 -1.5359 H 1 UNL111111111 0.1792 25 H 3.5562 -2.1008 0.4398 H 1 UNL111111111 0.1636 26 H 2.3497 2.2107 1.1107 H 1 UNL111111111 0.1646 27 H 0.9417 0.4595 1.9381 H 1 UNL111111111 0.1344 28 H -0.9084 -0.4497 1.6511 H 1 UNL111111111 0.1509 29 H 4.1067 0.1012 2.1912 H 1 UNL111111111 0.1490 30 H 5.4150 -0.5353 1.1233 H 1 UNL111111111 0.1439 31 H -1.4947 1.7930 0.4658 H 1 UNL111111111 0.1711 32 H -0.8829 -1.8133 -1.1005 H 1 UNL111111111 0.1742 33 H -3.3693 0.7487 1.7009 H 1 UNL111111111 0.1588 34 H -3.3563 -2.7233 -0.0122 H 1 UNL111111111 0.1629 35 H 5.1581 -0.2964 -1.4459 H 1 UNL111111111 0.3271 36 H 0.5057 1.6665 -0.9254 H 1 UNL111111111 0.3563 37 H -5.1429 0.6062 -0.5600 H 1 UNL111111111 0.1256 38 H -3.9303 1.8668 -1.0244 H 1 UNL111111111 0.1750 39 H -2.1994 0.1488 -1.7267 H 1 UNL111111111 0.3471 40 H -0.0739 -2.7411 0.9045 H 1 UNL111111111 0.3391 41 H -4.0848 -1.2930 -1.8080 H 1 UNL111111111 0.3469 42 H -5.4936 1.8930 1.3245 H 1 UNL111111111 0.3113 @BOND 1 1 13 1 2 1 15 1 3 2 11 1 4 2 17 1 5 3 15 1 6 3 16 1 7 4 20 1 8 4 21 1 9 5 12 1 10 5 35 1 11 6 14 1 12 6 36 1 13 7 18 1 14 7 39 1 15 8 19 1 16 8 40 1 17 9 21 1 18 9 41 1 19 10 22 1 20 10 42 1 21 11 12 1 22 11 14 1 23 11 23 1 24 12 13 1 25 12 24 1 26 13 17 1 27 13 25 1 28 14 15 1 29 14 26 1 30 15 27 1 31 16 18 1 32 16 19 1 33 16 28 1 34 17 29 1 35 17 30 1 36 18 20 1 37 18 31 1 38 19 21 1 39 19 32 1 40 20 22 1 41 20 33 1 42 21 34 1 43 22 37 1 44 22 38 1