B1EMQ7 -OEChem-04042107223D 48 50 0 0 0 0 0 0 0999 V2000 -6.3311 -0.0161 0.2174 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 -2.6715 -0.0083 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1928 -0.0314 1.8900 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0679 -2.3667 1.2144 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8527 -4.0534 -0.4150 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6918 -0.9571 -0.0391 O 0 5 0 0 0 0 0 0 0 0 0 0 7.4204 0.7570 -1.3836 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0465 -1.8081 -1.3022 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7337 1.1371 0.3598 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5405 0.1913 0.8751 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9688 -0.0715 -0.5564 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.2287 -1.8988 0.0832 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4657 -0.7793 0.8846 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5308 -1.8691 -0.6487 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2599 -2.4429 -0.6823 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7395 -0.2071 0.9162 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7708 -0.7513 0.1506 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6088 -2.4816 -1.4835 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5288 1.1515 0.7305 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4322 2.1639 0.2073 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1450 1.9225 -0.9673 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5865 3.3760 0.8801 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8945 0.1256 0.5178 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0116 2.8934 -1.4692 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4533 4.3467 0.3782 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7255 -0.8508 1.0775 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4269 1.0362 -0.4014 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5973 -0.0051 -0.1949 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1659 4.1054 -0.7964 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0728 -0.9159 0.7223 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7743 0.9710 -0.7568 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0819 -3.3076 -1.3161 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9375 0.6612 1.5423 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4340 -2.8277 -0.8524 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2478 -3.3498 -2.0459 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9862 -1.7590 -2.2145 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8009 -1.1467 -1.0827 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1735 -2.3026 -2.1936 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0226 0.9909 -1.5137 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0361 3.5757 1.7959 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1791 -0.4801 1.5423 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3292 -1.5673 1.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8148 1.8090 -0.8593 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5639 2.7066 -2.3854 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5734 5.2906 0.9018 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8403 4.8615 -1.1875 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6839 -1.6896 1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1484 1.6968 -1.4744 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 2 4 2 0 0 0 0 2 5 2 0 0 0 0 2 8 1 0 0 0 0 2 12 1 0 0 0 0 3 13 1 0 0 0 0 3 19 1 0 0 0 0 6 11 1 0 0 0 0 7 11 2 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 19 2 0 0 0 0 10 23 1 0 0 0 0 10 41 1 0 0 0 0 11 28 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 16 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 14 18 1 0 0 0 0 15 32 1 0 0 0 0 16 17 2 0 0 0 0 16 33 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 24 1 0 0 0 0 21 39 1 0 0 0 0 22 25 2 0 0 0 0 22 40 1 0 0 0 0 23 26 2 0 0 0 0 23 27 1 0 0 0 0 24 29 2 0 0 0 0 24 44 1 0 0 0 0 25 29 1 0 0 0 0 25 45 1 0 0 0 0 26 30 1 0 0 0 0 26 42 1 0 0 0 0 27 31 2 0 0 0 0 27 43 1 0 0 0 0 28 30 2 0 0 0 0 28 31 1 0 0 0 0 29 46 1 0 0 0 0 30 47 1 0 0 0 0 31 48 1 0 0 0 0 M CHG 2 6 -1 11 1 M END $$$$