BJ29KE -OEChem-04022109433D 28 29 0 0 0 0 0 0 0999 V2000 3.2510 -1.8319 0.5163 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7206 -0.4608 -0.1055 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3147 1.7632 -0.6937 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5077 1.7879 0.3378 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5482 -0.3307 0.0649 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1756 -0.0807 0.0822 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5690 0.4178 0.1168 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7041 1.2097 0.3229 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2749 -1.1220 -0.1411 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6683 1.4591 0.3403 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0975 -0.8727 -0.1239 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5048 0.6129 -0.3215 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9998 0.6773 0.1338 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8661 0.0274 -0.2223 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8307 -1.2340 0.2029 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1465 -0.3336 -0.1155 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7606 -1.6890 -0.3945 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3624 2.0416 0.5506 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6012 -2.1363 -0.3524 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0154 2.4695 0.5402 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7616 -1.7128 -0.3075 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7554 0.5845 -0.4727 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7124 -1.8442 0.3444 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4426 0.3764 -0.8955 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4854 0.0345 0.8591 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4567 -2.4138 0.3679 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4147 -2.0775 -1.3581 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8523 -1.6283 -0.4093 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 15 1 0 0 0 0 2 13 1 0 0 0 0 2 16 1 0 0 0 0 3 12 2 0 0 0 0 4 13 2 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 7 10 2 0 0 0 0 7 11 1 0 0 0 0 7 13 1 0 0 0 0 8 10 1 0 0 0 0 8 18 1 0 0 0 0 9 11 2 0 0 0 0 9 19 1 0 0 0 0 10 20 1 0 0 0 0 11 21 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 24 1 0 0 0 0 16 25 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 M END $$$$