BAUF90 -OEChem-04022101202D 40 41 0 0 0 0 0 0 0999 V2000 3.4088 0.3685 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4088 -1.8784 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4339 0.1460 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4339 -1.6559 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.7550 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.8547 -1.7791 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0730 -2.7896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9216 2.7896 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0730 1.2796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0846 0.2797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9332 1.7896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9906 -0.2341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1906 -0.2550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9906 -1.2758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1906 -1.2550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0846 -1.7896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8547 0.2692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7818 3.2995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0499 3.2795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7227 -1.2824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9332 -3.2995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8543 1.8598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4637 1.1649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1520 1.2095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5425 1.9043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1668 -0.2665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3905 0.5813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5427 0.8049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0980 2.7662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3152 3.6157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4656 3.8328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3537 3.8200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5094 3.5833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7461 2.7390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0306 -1.8206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2608 -0.9745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4148 -0.7443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6170 -3.8328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4665 -3.6157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2494 -2.7662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 13 1 0 0 0 0 2 4 1 0 0 0 0 2 15 1 0 0 0 0 3 5 1 0 0 0 0 4 5 1 0 0 0 0 6 14 1 0 0 0 0 6 20 1 0 0 0 0 7 16 1 0 0 0 0 7 21 1 0 0 0 0 8 11 1 0 0 0 0 8 18 1 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 13 15 2 0 0 0 0 14 16 2 0 0 0 0 15 16 1 0 0 0 0 17 26 1 0 0 0 0 17 27 1 0 0 0 0 17 28 1 0 0 0 0 18 29 1 0 0 0 0 18 30 1 0 0 0 0 18 31 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 M END $$$$