D00227 -OEChem-05072121472D 54 56 0 1 0 0 0 0 0999 V2000 4.6038 3.9104 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.5961 1.9104 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.5243 -3.6071 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8602 -1.1312 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3904 1.8929 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9884 0.3929 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1224 1.8929 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3904 -1.1071 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3904 -2.1071 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.2564 -2.6071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5243 -0.6071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5243 -2.6071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5243 0.3929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2564 -3.6071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1224 -2.1071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2564 -0.6071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6304 -1.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2564 0.3929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7243 0.4138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3904 0.8929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6304 0.9276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7243 -0.6279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8602 0.9171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 1.9171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1224 0.8929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.4137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.4204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 -2.1312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7359 3.4137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0038 3.4204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8718 3.9171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8534 -1.7971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7933 -2.9171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3123 -2.0244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9138 -2.7147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6364 -3.6071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2564 -4.2271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8764 -3.6071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4324 -2.6440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6594 -1.7971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8124 -1.5701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7933 -0.9171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6376 -1.7617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6376 1.5476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2501 1.0271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6459 0.3353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9874 -3.9171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4619 2.1125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2441 -2.1336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8665 -2.7512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4841 -2.1288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4681 3.7325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5254 0.7029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8742 4.5371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 2 26 1 0 0 0 0 3 12 1 0 0 0 0 3 47 1 0 0 0 0 4 22 1 0 0 0 0 4 28 1 0 0 0 0 5 20 2 0 0 0 0 6 25 1 0 0 0 0 6 53 1 0 0 0 0 7 25 2 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 1 0 0 0 9 32 1 0 0 0 0 10 14 1 0 0 0 0 10 15 1 0 0 0 0 10 33 1 0 0 0 0 11 13 2 0 0 0 0 11 17 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 20 1 0 0 0 0 13 21 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 18 2 0 0 0 0 16 42 1 0 0 0 0 17 22 2 0 0 0 0 17 43 1 0 0 0 0 18 20 1 0 0 0 0 18 25 1 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 19 23 1 0 0 0 0 21 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 26 29 1 0 0 0 0 27 30 2 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 29 31 2 0 0 0 0 30 31 1 0 0 0 0 30 52 1 0 0 0 0 31 54 1 0 0 0 0 M END $$$$