BRL17K -OEChem-04022107413D 31 32 0 0 0 0 0 0 0999 V2000 -6.7165 1.5613 0.0601 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.1942 1.4269 -0.8936 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7315 0.6027 1.5005 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5108 1.3899 0.3334 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3427 -1.8533 0.0536 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5288 -0.4415 -0.5704 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2307 -0.7617 0.0554 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5629 -0.1975 0.0563 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1373 0.0290 -0.2805 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1172 -0.5592 -0.2663 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0388 -2.0975 0.3902 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6628 -1.0056 -0.2318 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7476 1.1545 0.3456 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2951 0.2202 -0.6062 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2558 -2.5906 0.3743 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9472 -0.4618 -0.2307 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0321 1.6984 0.3467 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1318 0.8903 0.0585 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7904 0.2017 -0.8594 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4411 0.7938 0.3642 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2459 1.0669 -0.5772 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8423 -2.7617 0.6892 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5646 -2.0561 -0.4914 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9252 1.8152 0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4604 -3.6240 0.6344 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7948 -1.1015 -0.4632 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1621 2.7520 0.5804 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5489 -1.4226 -0.3071 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6283 1.0000 -1.5893 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4551 -0.5612 -1.2742 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1756 0.9963 2.2816 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 2 14 2 0 0 0 0 3 20 1 0 0 0 0 3 31 1 0 0 0 0 4 20 2 0 0 0 0 5 10 2 0 0 0 0 5 15 1 0 0 0 0 6 14 1 0 0 0 0 6 19 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 7 11 1 0 0 0 0 8 12 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 21 1 0 0 0 0 10 14 1 0 0 0 0 11 15 2 0 0 0 0 11 22 1 0 0 0 0 12 16 1 0 0 0 0 12 23 1 0 0 0 0 13 17 2 0 0 0 0 13 24 1 0 0 0 0 15 25 1 0 0 0 0 16 18 2 0 0 0 0 16 26 1 0 0 0 0 17 18 1 0 0 0 0 17 27 1 0 0 0 0 19 20 1 0 0 0 0 19 29 1 0 0 0 0 19 30 1 0 0 0 0 M END $$$$