B96PXD -OEChem-04022106132D 44 45 0 1 0 0 0 0 0999 V2000 7.8545 3.7427 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.1204 3.3649 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3100 1.6821 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7188 2.8056 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3100 1.6821 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5006 2.1821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7439 0.7811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9413 3.7805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7439 2.5831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7188 0.5586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5006 1.1821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2083 4.4607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3946 2.7168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3946 0.6474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4308 5.4356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3006 2.2029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3006 1.1613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3864 5.7304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6978 6.1158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6089 6.7053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9203 7.0907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8758 7.3855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2804 3.2440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9801 1.1571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5126 3.5397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2777 4.3013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1394 0.6432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7439 0.1611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4498 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2036 0.1720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6370 4.7015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8719 3.9399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3874 3.3367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3874 0.0275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 1.1451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 2.2190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8364 2.5150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8364 0.8492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8409 5.3087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1053 5.9330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2014 6.8880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4658 7.5124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0138 7.9899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8545 3.7427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 44 1 0 0 0 0 2 9 2 0 0 0 0 5 3 1 6 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 1 0 0 0 4 9 1 0 0 0 0 4 23 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 5 24 1 0 0 0 0 6 11 1 0 0 0 0 6 13 2 0 0 0 0 7 10 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 12 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 14 2 0 0 0 0 12 15 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 16 1 0 0 0 0 13 33 1 0 0 0 0 14 17 1 0 0 0 0 14 34 1 0 0 0 0 15 18 2 0 0 0 0 15 19 1 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 18 20 1 0 0 0 0 18 39 1 0 0 0 0 19 21 2 0 0 0 0 19 40 1 0 0 0 0 20 22 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 43 1 0 0 0 0 M END $$$$