84571 Marvin 02230614483D alpha_lactose charge=0 45 46 0 0 1 0 999 V2000 0.9268 0.1866 0.4588 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4731 0.1184 0.4447 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0381 0.8706 1.6793 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4488 2.3052 1.7959 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8911 2.2676 1.7436 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2031 3.6536 1.7214 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4255 -0.4024 -0.7452 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9085 -1.2419 0.4568 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4626 0.8925 1.6274 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9621 3.1225 0.7442 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4508 1.5416 0.5775 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5235 4.4200 2.8770 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6315 -2.7749 -2.2076 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2868 -1.5402 -3.0726 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.0052 -0.8555 -2.5337 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9797 -0.6269 -0.9886 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.5831 -1.8315 -0.1870 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.0515 -1.5277 1.2631 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6769 -3.8237 -2.3670 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1054 -1.9199 -4.4372 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7985 0.3889 -3.2046 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7539 -2.3762 -0.8325 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5919 -2.6735 1.9112 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6248 -0.4021 1.3192 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8483 0.5795 -0.4735 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7738 0.3115 2.5832 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7711 2.7469 2.7428 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5184 1.7535 2.6369 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8819 3.5292 1.6935 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4970 4.2184 0.8343 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4925 -1.6603 -0.3267 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7429 1.3289 2.4591 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9358 3.1082 0.8557 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0377 5.2644 2.7653 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6005 -3.1725 -2.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1234 -0.8360 -3.0324 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1657 -1.5005 -2.8172 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5677 0.2723 -0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8241 -2.6169 -0.1264 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7953 -0.7292 1.2762 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2399 -1.2261 1.9156 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9473 -4.5181 -1.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9234 -2.3934 -4.6967 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7295 0.1712 -4.1583 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6935 -2.4020 2.8494 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 7 1 0 0 0 0 1 11 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 5 28 1 0 0 0 0 6 12 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 16 1 0 0 0 0 8 31 1 0 0 0 0 9 32 1 0 0 0 0 10 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 13 22 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 21 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 39 1 0 0 0 0 18 23 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 20 43 1 0 0 0 0 21 44 1 0 0 0 0 23 45 1 0 0 0 0 M END