BP12ID -OEChem-04022107283D 43 45 0 1 0 0 0 0 0999 V2000 1.9987 3.4390 1.0160 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7566 -0.7704 -0.8850 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1813 -0.5257 2.1348 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0132 -0.8941 -2.3766 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5275 -0.7531 -0.0989 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0258 -0.0085 -1.7918 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6629 0.8823 0.3720 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6214 2.0878 -0.4752 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7282 -1.3380 0.2956 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9353 -2.7315 -0.3123 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0207 -3.5829 0.3772 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 -4.9368 -0.3056 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6519 -3.7970 1.8479 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8356 -0.3900 -0.1674 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4186 -0.3819 0.9379 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8006 -0.5751 -1.4816 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7027 0.2137 0.5206 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9675 0.3822 -0.8349 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6488 0.6074 1.4726 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1773 0.9443 -1.2502 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8575 1.1686 1.0575 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1215 1.3368 -0.3016 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5043 2.0092 0.2132 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3831 4.2438 0.4019 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1236 3.3699 -0.3661 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7913 -1.3819 1.3842 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0139 -3.2837 -0.2629 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1892 -2.6757 -1.3772 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9800 -3.0536 0.3404 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3021 -5.5336 -0.2772 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0142 -5.5099 0.1843 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5036 -4.8014 -1.3545 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6253 -4.1633 1.9568 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3179 -4.5364 2.3075 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7600 -2.8822 2.4368 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2551 0.1327 -2.7715 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8512 1.0558 0.9589 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4650 0.4861 2.5364 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3949 1.0809 -2.3063 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5941 1.4752 1.7945 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0629 1.7738 -0.6215 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5825 5.2824 0.6234 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0462 3.6194 -0.8726 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 14 2 0 0 0 0 3 15 2 0 0 0 0 4 16 2 0 0 0 0 5 9 1 0 0 0 0 5 15 1 0 0 0 0 5 16 1 0 0 0 0 6 16 1 0 0 0 0 6 18 1 0 0 0 0 6 36 1 0 0 0 0 7 14 1 0 0 0 0 7 23 1 0 0 0 0 7 37 1 0 0 0 0 8 23 2 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 29 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 2 0 0 0 0 18 20 2 0 0 0 0 19 21 1 0 0 0 0 19 38 1 0 0 0 0 20 22 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 24 25 2 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 M END $$$$