BQ2JU3 -OEChem-04022106443D 31 32 0 1 0 0 0 0 0999 V2000 -5.5396 0.3458 -0.1459 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.1829 -2.4024 -1.1631 O 0 5 0 0 0 0 0 0 0 0 0 0 2.2193 -2.4663 1.0382 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0586 0.3648 0.0257 N 0 0 3 0 0 0 0 0 0 0 0 0 3.1306 1.6223 0.0401 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4995 -1.9349 -0.0528 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.2244 -0.1892 -1.1808 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2929 1.6147 0.1584 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0608 2.7963 -0.4378 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4544 2.8941 0.1744 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4704 0.3960 0.0154 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2759 -0.8667 0.0858 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1954 -0.5571 0.0812 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2208 -0.7264 -0.0297 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8892 -0.3561 1.2693 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9027 -0.4635 -1.1066 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2498 -0.0717 1.2338 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8651 0.0002 -0.0055 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0925 1.8093 1.2192 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6518 1.6347 -0.3871 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5113 3.7286 -0.2655 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1473 2.6644 -1.5243 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0338 3.6766 -0.3261 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3852 3.1572 1.2358 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4005 -1.3934 1.0319 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3537 -1.4827 -0.8055 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1456 1.6082 0.0493 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2925 -0.8447 -0.0459 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3829 -0.4158 2.2289 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4189 -0.6058 -2.0682 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7997 0.0874 2.1553 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 2 6 1 0 0 0 0 3 6 2 0 0 0 0 4 8 1 0 0 0 0 4 11 1 0 0 0 0 4 12 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 5 27 1 0 0 0 0 6 14 1 0 0 0 0 7 16 1 0 0 0 0 7 18 2 0 0 0 0 8 9 1 0 0 0 0 8 19 1 0 0 0 0 8 20 1 0 0 0 0 9 10 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 11 14 2 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 12 26 1 0 0 0 0 13 15 1 0 0 0 0 13 16 2 0 0 0 0 14 28 1 0 0 0 0 15 17 2 0 0 0 0 15 29 1 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 M CHG 2 2 -1 6 1 M END $$$$