D0Q3KS -OEChem-10101305032D 50 53 0 0 0 0 0 0 0999 V2000 7.0468 2.9050 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 5.9050 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 12.2429 -4.0950 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 11.3769 -5.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -0.0950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -2.5950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 1.4050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -0.0950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 1.4983 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4782 2.8995 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 -4.0950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.3769 -4.5950 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 9.6448 -5.5950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -1.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 2.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 -3.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 3.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 3.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6448 -2.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 4.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 4.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5109 -4.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5109 -3.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6448 -4.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 4.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.2414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 3.1074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4362 -0.9873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8347 -1.6776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5234 -1.7027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1249 -1.0124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5837 0.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3759 -2.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9118 0.0950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9118 3.0950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5402 0.8918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6448 -1.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7177 4.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9118 4.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0478 -2.7850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 2.1766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2478 3.6738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1079 -5.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1818 -5.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 2 31 1 0 0 0 0 3 12 1 0 0 0 0 4 12 2 0 0 0 0 5 14 1 0 0 0 0 5 19 1 0 0 0 0 5 38 1 0 0 0 0 6 15 1 0 0 0 0 6 22 1 0 0 0 0 6 39 1 0 0 0 0 7 16 2 0 0 0 0 7 19 1 0 0 0 0 8 19 2 0 0 0 0 8 21 1 0 0 0 0 9 20 1 0 0 0 0 9 32 1 0 0 0 0 9 42 1 0 0 0 0 10 20 2 0 0 0 0 10 33 1 0 0 0 0 11 22 2 0 0 0 0 11 30 1 0 0 0 0 12 28 1 0 0 0 0 13 30 1 0 0 0 0 13 49 1 0 0 0 0 13 50 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 20 1 0 0 0 0 17 21 2 0 0 0 0 18 23 2 0 0 0 0 18 24 1 0 0 0 0 21 40 1 0 0 0 0 22 25 1 0 0 0 0 23 26 1 0 0 0 0 24 27 2 0 0 0 0 24 41 1 0 0 0 0 25 29 2 0 0 0 0 25 43 1 0 0 0 0 26 31 2 0 0 0 0 26 44 1 0 0 0 0 27 31 1 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 28 30 2 0 0 0 0 29 46 1 0 0 0 0 32 33 2 0 0 0 0 32 47 1 0 0 0 0 33 48 1 0 0 0 0 M CHG 2 3 -1 12 1 M END $$$$