D02KAU -OEChem-04152122423D 52 56 0 1 0 0 0 0 0999 V2000 -5.8765 -0.0494 -1.5351 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.8069 -2.4982 0.8785 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5100 -0.6816 -0.2929 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0716 0.0133 0.1039 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0765 -0.6530 0.4279 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9471 -3.3130 -0.0323 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9791 2.4472 0.4374 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8110 1.3025 -0.5463 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6184 1.0971 -1.0692 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1613 3.8014 -0.2409 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2442 2.3337 1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7564 4.6861 0.8502 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4433 3.7402 1.8368 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6216 2.2341 -0.9745 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0424 -0.0375 -0.1774 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0034 1.7296 -1.4026 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4685 -0.3784 -0.0716 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4145 0.4825 -0.6551 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2713 -0.6495 0.0669 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8683 -1.5317 0.6085 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7714 0.1445 -0.5701 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3509 -0.1005 -0.6251 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4119 -1.8734 0.7213 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1735 -1.0099 0.1043 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2244 -1.8436 0.6943 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5711 -0.7755 -0.6629 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6321 -2.5482 0.6838 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7117 -1.9994 -0.0085 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5864 -1.3445 0.1904 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9467 -2.7251 -0.0217 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1354 2.4897 1.1385 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4285 1.4691 -1.4348 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5786 0.7027 -2.0943 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2338 4.2324 -0.6224 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8671 3.7308 -1.0778 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1673 1.5958 2.0861 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1245 2.1073 0.6769 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4569 5.4159 0.4318 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9658 5.2461 1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9727 3.8301 2.8229 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5050 3.9780 1.9582 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7053 2.6222 0.0467 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3303 3.0598 -1.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7359 2.5273 -1.2305 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0018 1.5049 -2.4763 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1436 -2.1974 1.0686 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5100 0.7951 -1.0337 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2891 0.8414 -1.1586 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5941 -2.3252 1.2767 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4974 -2.7496 1.2281 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7248 -3.5003 1.2013 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7623 -2.7148 0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 2 29 1 0 0 0 0 2 52 1 0 0 0 0 3 29 2 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 19 1 0 0 0 0 5 15 2 0 0 0 0 6 30 3 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 7 11 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 14 1 0 0 0 0 9 15 1 0 0 0 0 9 33 1 0 0 0 0 10 12 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 13 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 16 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 17 1 0 0 0 0 16 18 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 21 1 0 0 0 0 19 22 2 0 0 0 0 19 23 1 0 0 0 0 20 25 2 0 0 0 0 20 46 1 0 0 0 0 21 24 2 0 0 0 0 21 47 1 0 0 0 0 22 26 1 0 0 0 0 22 48 1 0 0 0 0 23 27 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 29 1 0 0 0 0 25 50 1 0 0 0 0 26 28 2 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 30 1 0 0 0 0 M END $$$$