BIR45S -OEChem-04022105233D 51 55 0 1 0 0 0 0 0999 V2000 8.4196 -0.2174 0.6731 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0153 3.4595 0.7062 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.5168 -2.8359 -1.1305 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6889 -3.9058 1.4152 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5997 1.1704 -0.4374 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8599 1.3647 0.0344 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6091 1.9323 -0.7164 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4538 -0.0381 -1.2461 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8905 -0.5263 -1.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3939 -1.0515 -0.5535 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6012 0.4206 -0.4618 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5690 -1.5040 -1.1539 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 -1.5413 0.6963 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0177 0.2651 -0.1853 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3642 -2.4456 -0.5001 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3542 2.0888 -0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9687 -2.9561 0.7388 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8004 -2.4930 1.3447 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6598 1.1472 0.6837 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7369 -0.7664 -0.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4069 -3.5160 -0.2412 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6494 -4.5476 0.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0209 0.9978 0.9491 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0981 -0.9157 -0.5236 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8789 2.3401 -0.2407 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7401 -0.0337 0.3455 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8904 2.6665 -1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1184 2.4149 1.1314 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1412 3.0678 -0.6753 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3694 2.8162 1.6002 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3808 3.1427 0.6969 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0346 0.2322 -2.2224 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0459 -1.5774 -1.1438 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2497 -0.3417 -2.4199 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8764 -1.1200 -2.1235 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8923 -1.1996 1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4926 -2.8747 2.3144 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1231 1.9590 1.1675 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2793 -1.4711 -1.4761 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1773 -4.0015 -0.8484 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8950 -2.7732 0.4018 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3376 -5.1044 1.2155 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1261 -5.2653 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6306 1.5537 -1.6603 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 1.6925 1.6285 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6467 -1.7231 -1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7159 2.6125 -2.2155 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3699 2.1230 1.8622 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9290 3.3215 -1.3786 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5597 2.8639 2.6685 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3556 3.4526 1.0619 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 2 16 2 0 0 0 0 3 15 1 0 0 0 0 3 21 1 0 0 0 0 4 17 1 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 16 1 0 0 0 0 6 11 2 0 0 0 0 7 16 1 0 0 0 0 7 25 1 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 32 1 0 0 0 0 9 11 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 11 14 1 0 0 0 0 12 15 1 0 0 0 0 12 35 1 0 0 0 0 13 18 2 0 0 0 0 13 36 1 0 0 0 0 14 19 2 0 0 0 0 14 20 1 0 0 0 0 15 17 2 0 0 0 0 17 18 1 0 0 0 0 18 37 1 0 0 0 0 19 23 1 0 0 0 0 19 38 1 0 0 0 0 20 24 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 26 2 0 0 0 0 23 45 1 0 0 0 0 24 26 1 0 0 0 0 24 46 1 0 0 0 0 25 27 2 0 0 0 0 25 28 1 0 0 0 0 27 29 1 0 0 0 0 27 47 1 0 0 0 0 28 30 2 0 0 0 0 28 48 1 0 0 0 0 29 31 2 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 31 51 1 0 0 0 0 M END $$$$