BKD2M4 -OEChem-04012114472D 53 56 0 1 0 0 0 0 0999 V2000 5.7567 -3.2814 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7634 5.7798 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1646 4.7617 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6227 -1.7814 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8907 0.2187 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9771 -0.1881 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3080 0.5551 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4067 2.4392 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7567 -0.2813 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.6227 0.2187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7567 -1.2814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4888 -0.2813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4888 -1.2814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6227 -2.7814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4888 -3.2814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7861 1.2132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4888 -4.2814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8080 1.4211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3548 -4.7814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 2.3346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3548 -5.7814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2208 -4.2814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 3.1436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2208 -6.2814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0868 -4.7814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 4.0572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0868 -5.7814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.3527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 4.1617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1701 4.8662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7567 0.3387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0212 0.6936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2242 0.6936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1461 -1.1737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5446 -1.8640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0993 -0.3890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7008 0.3013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7008 -1.8640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0993 -1.1737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0993 -3.3890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7008 -2.6987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2469 1.6280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8782 -4.1737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2767 -4.8640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8178 -6.0914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2208 -3.6614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6056 3.0788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2208 -6.9014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6238 -4.4714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6238 -6.0914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 3.4175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3356 4.7281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1278 6.2814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 2 0 0 0 0 2 30 1 0 0 0 0 2 53 1 0 0 0 0 3 30 2 0 0 0 0 4 11 1 0 0 0 0 4 13 1 0 0 0 0 4 14 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 16 1 0 0 0 0 6 7 2 0 0 0 0 7 18 1 0 0 0 0 8 20 2 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 31 1 0 0 0 0 10 12 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 15 17 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 18 2 0 0 0 0 16 42 1 0 0 0 0 17 19 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 20 1 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 20 23 1 0 0 0 0 21 24 1 0 0 0 0 21 45 1 0 0 0 0 22 25 2 0 0 0 0 22 46 1 0 0 0 0 23 26 2 0 0 0 0 23 47 1 0 0 0 0 24 27 2 0 0 0 0 24 48 1 0 0 0 0 25 27 1 0 0 0 0 25 49 1 0 0 0 0 26 29 1 0 0 0 0 26 30 1 0 0 0 0 27 50 1 0 0 0 0 28 29 2 0 0 0 0 28 51 1 0 0 0 0 29 52 1 0 0 0 0 M END $$$$