@MOLECULE ethyl alpha-d-fructofuranoside 30 30 0 0 0 SMALL GASTEIGER @ATOM 1 O 0.4703 0.0135 0.8890 O.3 1 UNL1111111111 -0.4696 2 O -1.4753 0.4234 -0.3063 O.3 1 UNL1111111111 -0.4835 3 O 0.7490 -2.1801 -1.1958 O.3 1 UNL1111111111 -0.5103 4 O 0.6891 1.2853 -2.1130 O.3 1 UNL1111111111 -0.5269 5 O -2.5798 -1.6234 0.8991 O.3 1 UNL1111111111 -0.5256 6 O 3.0687 0.7512 1.8799 O.3 1 UNL1111111111 -0.5275 7 C -0.5436 -0.5502 0.0796 C.3 1 UNL1111111111 0.3423 8 C 0.1579 -0.9170 -1.2626 C.3 1 UNL1111111111 0.0337 9 C 1.2140 0.2114 -1.3846 C.3 1 UNL1111111111 0.0584 10 C 1.4753 0.6359 0.0793 C.3 1 UNL1111111111 0.0022 11 C -1.1739 -1.6911 0.8885 C.3 1 UNL1111111111 -0.0615 12 C 2.8165 0.1470 0.6319 C.3 1 UNL1111111111 -0.0297 13 C -1.9539 1.2791 0.7378 C.3 1 UNL1111111111 0.0037 14 C -2.8393 2.2779 0.0069 C.3 1 UNL1111111111 -0.4623 15 H -0.5289 -0.9788 -2.1304 H 1 UNL1111111111 0.1835 16 H 2.1163 -0.0838 -1.9542 H 1 UNL1111111111 0.1691 17 H 1.3541 1.7324 0.2224 H 1 UNL1111111111 0.1680 18 H -0.8973 -1.6379 1.9609 H 1 UNL1111111111 0.1622 19 H -0.8867 -2.6813 0.4806 H 1 UNL1111111111 0.1522 20 H 3.6677 0.4855 0.0087 H 1 UNL1111111111 0.1543 21 H 2.8477 -0.9508 0.7483 H 1 UNL1111111111 0.1208 22 H 1.3936 -2.2287 -0.4545 H 1 UNL1111111111 0.3158 23 H -0.2021 1.5312 -1.7576 H 1 UNL1111111111 0.3356 24 H -2.5124 0.6680 1.4704 H 1 UNL1111111111 0.1428 25 H -1.0946 1.7603 1.2365 H 1 UNL1111111111 0.1304 26 H -2.9156 -1.2692 0.0444 H 1 UNL1111111111 0.3274 27 H 2.3343 0.5561 2.5029 H 1 UNL1111111111 0.3226 28 H -3.3107 2.9726 0.7124 H 1 UNL1111111111 0.1580 29 H -2.2684 2.8689 -0.7194 H 1 UNL1111111111 0.1538 30 H -3.6388 1.7698 -0.5485 H 1 UNL1111111111 0.1600 @BOND 1 1 7 1 2 1 10 1 3 2 7 1 4 2 13 1 5 3 8 1 6 3 22 1 7 4 9 1 8 4 23 1 9 5 11 1 10 5 26 1 11 6 12 1 12 6 27 1 13 7 8 1 14 7 11 1 15 8 9 1 16 8 15 1 17 9 10 1 18 9 16 1 19 10 12 1 20 10 17 1 21 11 18 1 22 11 19 1 23 12 20 1 24 12 21 1 25 13 14 1 26 13 24 1 27 13 25 1 28 14 28 1 29 14 29 1 30 14 30 1