BBSW25 -OEChem-04022111183D 52 54 0 1 0 0 0 0 0999 V2000 6.5813 1.7070 0.2017 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6268 -4.2223 2.2227 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6613 -2.4733 0.1553 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8292 1.0228 -0.0253 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3665 -0.9142 0.0678 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0182 -0.2504 0.1043 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3072 2.6515 -0.0376 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6704 2.0408 0.0521 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7216 -2.9133 0.2016 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3599 -2.8452 -1.2056 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7804 -4.3168 0.8099 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8879 -2.7569 -1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9556 -4.0015 -2.1258 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1240 0.3862 -0.0385 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6127 0.4037 0.0224 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0359 -1.1448 0.1066 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6825 1.4308 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 1.0646 0.0573 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5936 2.3716 -0.0602 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8889 0.6926 -1.3285 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9524 0.7690 1.1903 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0793 1.9617 0.0878 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8495 2.9482 -0.5283 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7016 0.8966 0.7391 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2416 2.8696 -0.4932 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0938 0.8179 0.7742 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8637 1.8043 0.1579 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2732 -2.2490 0.8803 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0304 -1.9221 -1.7001 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4024 -3.1628 0.1038 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7516 -4.7873 0.6312 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -4.9723 0.4203 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9556 -0.6970 -0.0014 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3229 -3.6629 -0.6886 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1974 -1.9058 -0.5091 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3217 -2.6221 -2.1189 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3571 -4.9603 -1.7827 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1338 -4.0872 -2.1923 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3355 -3.8324 -3.1395 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3899 3.1025 -0.1015 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1318 1.7574 -1.4145 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8285 0.1310 -1.3623 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2980 0.4137 -2.2081 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1979 1.8367 1.1991 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4069 0.5451 2.1138 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8933 0.2090 1.2108 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6739 -5.1271 2.5758 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3225 2.9805 -0.1188 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3767 3.7827 -1.0398 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1379 0.1298 1.2602 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8289 3.6453 -0.9778 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5652 -0.0139 1.2915 H 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 2 11 1 0 0 0 0 2 47 1 0 0 0 0 3 9 1 0 0 0 0 3 16 1 0 0 0 0 3 30 1 0 0 0 0 4 14 1 0 0 0 0 4 15 1 0 0 0 0 4 19 1 0 0 0 0 5 15 2 0 0 0 0 5 16 1 0 0 0 0 6 16 2 0 0 0 0 6 18 1 0 0 0 0 7 17 1 0 0 0 0 7 19 2 0 0 0 0 8 18 1 0 0 0 0 8 22 1 0 0 0 0 8 48 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 28 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 10 29 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 20 1 0 0 0 0 14 21 1 0 0 0 0 14 33 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 23 25 1 0 0 0 0 23 49 1 0 0 0 0 24 26 2 0 0 0 0 24 50 1 0 0 0 0 25 27 2 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 M END $$$$