BV1TG8 -OEChem-04022106313D 46 48 0 0 0 0 0 0 0999 V2000 -5.0704 0.3097 0.7610 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1983 -0.4643 -0.7752 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7887 -2.5736 0.1167 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3820 -0.3005 -0.0072 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2920 -1.4169 -0.2064 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1963 0.7157 1.2221 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2749 1.6178 -1.9740 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1707 3.0354 -0.9205 O 0 5 0 0 0 0 0 0 0 0 0 0 3.2944 3.0692 1.2710 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4770 2.4987 0.1700 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.2321 -1.0677 -0.0193 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.6290 0.9833 1.1818 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2519 0.0561 0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0517 1.1971 0.1576 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2265 -1.3329 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8392 -1.2090 0.2063 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0263 -0.1918 0.0675 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4388 1.0732 0.0812 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7708 0.1474 0.3055 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1751 -0.4330 -0.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9755 -0.3722 -0.8101 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8789 0.6957 -1.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3587 0.6567 -1.4102 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4632 -0.4949 -0.7369 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9183 -1.3934 -0.2272 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9013 -3.6882 0.1838 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0986 -0.3328 1.2256 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8374 0.0466 0.6258 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5683 -1.2351 -0.1011 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9530 0.7531 1.0632 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4855 -0.3493 0.4262 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1693 -2.0607 0.2634 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0695 1.9583 0.0313 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7446 -1.5537 -0.7444 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9310 -0.0274 -1.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9011 1.4687 -1.8802 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5108 -2.2601 0.2739 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5184 -4.5926 0.1608 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2414 -3.7324 -0.6895 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3468 -3.7067 1.1283 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1642 -0.4296 1.0001 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7892 -1.1918 1.8291 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9418 0.5953 1.7843 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8923 -2.1310 -0.6199 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5960 1.5044 1.5091 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5523 -0.5086 0.3458 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 1 28 1 0 0 0 0 2 19 1 0 0 0 0 2 20 1 0 0 0 0 3 15 1 0 0 0 0 3 26 1 0 0 0 0 4 17 1 0 0 0 0 4 27 1 0 0 0 0 5 21 1 0 0 0 0 5 25 1 0 0 0 0 6 19 2 0 0 0 0 7 22 2 0 0 0 0 8 10 1 0 0 0 0 9 10 2 0 0 0 0 10 14 1 0 0 0 0 11 28 1 0 0 0 0 11 29 2 0 0 0 0 12 28 2 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 16 2 0 0 0 0 13 19 1 0 0 0 0 14 18 2 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 18 33 1 0 0 0 0 20 22 1 0 0 0 0 20 25 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 23 36 1 0 0 0 0 24 34 1 0 0 0 0 24 35 1 0 0 0 0 25 37 1 0 0 0 0 26 38 1 0 0 0 0 26 39 1 0 0 0 0 26 40 1 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 27 43 1 0 0 0 0 29 31 1 0 0 0 0 29 44 1 0 0 0 0 30 31 2 0 0 0 0 30 45 1 0 0 0 0 31 46 1 0 0 0 0 M CHG 2 8 -1 10 1 M END $$$$