@MOLECULE 1-o-acetyl-4-o-alpha-d-glucopyranosyl-alpha-d-glucopyranose 50 51 0 0 0 SMALL GASTEIGER @ATOM 1 O 0.7544 0.0437 0.6512 O.3 1 UNL1111111111 -0.4685 2 O 2.8331 -0.9110 0.8321 O.3 1 UNL1111111111 -0.4509 3 O -1.8908 -0.4013 -0.5150 O.3 1 UNL1111111111 -0.4332 4 O -1.9201 -0.4151 2.9439 O.3 1 UNL1111111111 -0.5586 5 O 1.6912 2.5093 1.3523 O.3 1 UNL1111111111 -0.5556 6 O 3.5102 2.7107 -0.9374 O.3 1 UNL1111111111 -0.5651 7 O -1.0990 2.0566 0.4293 O.3 1 UNL1111111111 -0.5325 8 O 3.5775 0.2868 -2.4804 O.3 1 UNL1111111111 -0.5457 9 O -3.5073 1.1514 -0.5539 O.3 1 UNL1111111111 -0.4398 10 O -2.6840 -3.0346 -0.3990 O.3 1 UNL1111111111 -0.5307 11 O 3.2691 -3.3481 -0.5720 O.3 1 UNL1111111111 -0.5328 12 O -4.4737 -0.6452 -1.5076 O.2 1 UNL1111111111 -0.5033 13 C -0.2699 -0.6878 1.3011 C.3 1 UNL1111111111 0.0490 14 C -1.0718 0.3541 2.1193 C.3 1 UNL1111111111 0.0524 15 C -1.0714 -1.3330 0.1553 C.3 1 UNL1111111111 0.0501 16 C 2.0014 0.1057 1.3064 C.3 1 UNL1111111111 0.2729 17 C 2.5558 1.4982 0.9220 C.3 1 UNL1111111111 0.0325 18 C 2.7555 1.5649 -0.6004 C.3 1 UNL1111111111 0.0501 19 C -1.9442 1.2522 1.2100 C.3 1 UNL1111111111 0.0516 20 C 3.6140 0.3750 -1.0731 C.3 1 UNL1111111111 0.0758 21 C 2.9946 -0.9500 -0.5851 C.3 1 UNL1111111111 0.0508 22 C -2.7859 0.3141 0.3229 C.3 1 UNL1111111111 0.2739 23 C -1.9046 -2.5274 0.6537 C.3 1 UNL1111111111 -0.0524 24 C 3.9442 -2.1326 -0.8087 C.3 1 UNL1111111111 -0.0193 25 C -4.2744 0.5393 -1.5084 C.2 1 UNL1111111111 0.6490 26 C -4.7988 1.5674 -2.4446 C.3 1 UNL1111111111 -0.5081 27 H 0.1495 -1.4701 1.9727 H 1 UNL1111111111 0.1537 28 H -0.3846 0.9756 2.7347 H 1 UNL1111111111 0.1431 29 H -0.3926 -1.6414 -0.6832 H 1 UNL1111111111 0.1841 30 H 1.9423 -0.0813 2.3962 H 1 UNL1111111111 0.1424 31 H 3.5025 1.7180 1.4692 H 1 UNL1111111111 0.1707 32 H 1.7875 1.6166 -1.1474 H 1 UNL1111111111 0.1504 33 H -2.5639 1.9769 1.7765 H 1 UNL1111111111 0.1607 34 H 4.6723 0.4973 -0.7538 H 1 UNL1111111111 0.1439 35 H 2.0039 -1.1332 -1.0610 H 1 UNL1111111111 0.1681 36 H -3.4694 -0.3659 0.8694 H 1 UNL1111111111 0.1492 37 H -2.5607 -2.2626 1.5034 H 1 UNL1111111111 0.1368 38 H -1.2642 -3.3825 0.9419 H 1 UNL1111111111 0.1506 39 H 4.8351 -2.0817 -0.1584 H 1 UNL1111111111 0.1262 40 H 4.2494 -2.2009 -1.8730 H 1 UNL1111111111 0.1668 41 H -2.2262 0.0999 3.7175 H 1 UNL1111111111 0.3303 42 H 0.7599 2.3440 1.0496 H 1 UNL1111111111 0.3519 43 H 3.1373 3.4988 -0.4815 H 1 UNL1111111111 0.3401 44 H -0.7416 1.5192 -0.3271 H 1 UNL1111111111 0.3471 45 H 3.8053 1.1623 -2.8701 H 1 UNL1111111111 0.3386 46 H -3.2000 -2.3034 -0.8234 H 1 UNL1111111111 0.3438 47 H 2.8538 -3.3286 0.3157 H 1 UNL1111111111 0.3174 48 H -4.3281 1.4567 -3.4372 H 1 UNL1111111111 0.1937 49 H -4.6018 2.5968 -2.1022 H 1 UNL1111111111 0.1897 50 H -5.8861 1.4541 -2.5837 H 1 UNL1111111111 0.1889 @BOND 1 1 13 1 2 1 16 1 3 2 16 1 4 2 21 1 5 3 15 1 6 3 22 1 7 4 14 1 8 4 41 1 9 5 17 1 10 5 42 1 11 6 18 1 12 6 43 1 13 7 19 1 14 7 44 1 15 8 20 1 16 8 45 1 17 9 22 1 18 9 25 1 19 10 23 1 20 10 46 1 21 11 24 1 22 11 47 1 23 12 25 2 24 13 14 1 25 13 15 1 26 13 27 1 27 14 19 1 28 14 28 1 29 15 23 1 30 15 29 1 31 16 17 1 32 16 30 1 33 17 18 1 34 17 31 1 35 18 20 1 36 18 32 1 37 19 22 1 38 19 33 1 39 20 21 1 40 20 34 1 41 21 24 1 42 21 35 1 43 22 36 1 44 23 37 1 45 23 38 1 46 24 39 1 47 24 40 1 48 25 26 1 49 26 48 1 50 26 49 1 51 26 50 1