BK1WJ3 -OEChem-04022103173D 30 32 0 0 0 0 0 0 0999 V2000 1.4855 2.0260 -1.4083 S 0 0 0 0 0 0 0 0 0 0 0 0 5.8315 0.3354 0.7972 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 -0.5200 0.9092 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8257 -1.9758 0.0075 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.4723 -1.9004 -1.7192 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9282 0.0022 0.1020 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8575 0.8600 -0.9359 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8371 -1.4877 -0.5917 N 0 3 0 0 0 0 0 0 0 0 0 0 4.3972 -1.4437 -0.4113 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2919 1.1556 -0.0163 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1359 1.3190 -0.5997 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1430 1.7386 -0.6907 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0067 0.1223 -0.6222 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5616 0.1630 0.2309 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6795 1.6304 1.2368 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5918 0.8776 -0.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1089 -0.4363 0.0249 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7818 1.0720 1.8838 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4965 0.0384 1.2781 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5846 -0.1494 -0.2776 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1595 -1.3163 1.1226 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3012 -2.1110 0.3919 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3818 2.5950 -1.3187 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6880 -0.2333 -1.6002 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1326 2.4353 1.7222 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3956 -0.7453 0.6037 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0832 1.4419 2.8595 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3496 -0.3724 1.8119 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9380 -1.6174 1.8087 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2926 -3.1924 0.4093 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 16 1 0 0 0 0 2 20 1 0 0 0 0 2 21 1 0 0 0 0 3 14 2 0 0 0 0 4 8 1 0 0 0 0 5 8 2 0 0 0 0 6 14 1 0 0 0 0 6 16 1 0 0 0 0 6 26 1 0 0 0 0 7 16 2 0 0 0 0 7 20 1 0 0 0 0 8 17 1 0 0 0 0 9 20 2 0 0 0 0 9 22 1 0 0 0 0 10 12 1 0 0 0 0 10 13 2 0 0 0 0 10 15 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 23 1 0 0 0 0 13 17 1 0 0 0 0 13 24 1 0 0 0 0 15 18 2 0 0 0 0 15 25 1 0 0 0 0 17 19 2 0 0 0 0 18 19 1 0 0 0 0 18 27 1 0 0 0 0 19 28 1 0 0 0 0 21 22 2 0 0 0 0 21 29 1 0 0 0 0 22 30 1 0 0 0 0 M CHG 2 4 -1 8 1 M END $$$$