B5TVG4 -OEChem-04022109312D 44 46 0 0 0 0 0 0 0999 V2000 9.3244 2.6423 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.2111 4.8294 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1130 0.7906 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.5772 0.7906 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.2603 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.6420 4.5204 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.2601 2.6183 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.9360 1.9221 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.8451 1.7906 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1130 -4.2094 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8451 -4.2094 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2111 4.8294 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7111 3.2906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7111 2.2906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5202 3.8784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9021 3.8784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8451 -1.2094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8451 -2.2094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4712 3.5694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8451 0.7906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9791 -0.7094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7111 -0.7094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9791 -2.7094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9791 0.2906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7111 0.2906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 3.5694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6791 2.5912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2144 4.2385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6302 2.2822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1654 3.9295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3733 2.9513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9791 -3.7094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9232 1.7080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3217 2.3982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0572 -2.7920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4557 -2.1018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4421 -1.0194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2481 -1.0194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7670 -2.1268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3685 -2.8171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0854 4.8449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7591 1.6757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6262 4.3443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1130 -4.8294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 31 1 0 0 0 0 2 12 1 0 0 0 0 2 16 1 0 0 0 0 3 24 1 0 0 0 0 4 25 1 0 0 0 0 5 26 1 0 0 0 0 6 26 1 0 0 0 0 7 26 1 0 0 0 0 8 27 1 0 0 0 0 9 14 1 0 0 0 0 9 20 1 0 0 0 0 10 32 1 0 0 0 0 10 44 1 0 0 0 0 11 32 2 0 0 0 0 12 15 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 2 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 19 1 0 0 0 0 16 26 1 0 0 0 0 17 18 1 0 0 0 0 17 21 2 0 0 0 0 17 22 1 0 0 0 0 18 23 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 27 2 0 0 0 0 19 28 1 0 0 0 0 20 24 2 0 0 0 0 20 25 1 0 0 0 0 21 24 1 0 0 0 0 21 37 1 0 0 0 0 22 25 2 0 0 0 0 22 38 1 0 0 0 0 23 32 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 27 29 1 0 0 0 0 28 30 2 0 0 0 0 28 41 1 0 0 0 0 29 31 2 0 0 0 0 29 42 1 0 0 0 0 30 31 1 0 0 0 0 30 43 1 0 0 0 0 M END $$$$