B64TUS -OEChem-04042103583D 46 49 0 1 0 0 0 0 0999 V2000 -7.7090 0.2521 -0.4906 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.8743 -0.1899 -1.3119 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5403 -2.2487 1.8830 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3687 -3.2016 0.1773 O 0 5 0 0 0 0 0 0 0 0 0 0 1.7311 -2.3223 -0.9905 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0677 -0.0763 1.2278 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8534 -2.2387 -0.4383 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.8389 -1.0292 0.0016 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2970 -0.8122 1.4134 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6713 1.1686 0.6319 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1851 -1.1265 1.5124 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4684 -0.2217 1.6209 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2511 1.2429 -0.4346 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3166 -0.7055 -0.1226 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4010 -0.0248 0.4609 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 2.3646 1.1052 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 2.4957 -0.9692 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1032 -1.3847 -1.0531 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8883 0.2704 0.6938 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5660 -1.0101 -0.5125 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8807 3.6022 0.5719 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0463 3.6684 -0.4597 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1104 1.1727 0.3685 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4612 -1.0877 -1.1675 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2462 0.5675 0.5794 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4405 -0.7980 -1.5782 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0327 -0.1115 -0.3512 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9850 1.3847 -0.6973 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1501 0.3994 -1.6707 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7242 -2.1002 -0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8200 -1.4775 2.1144 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4506 0.1953 1.8116 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6486 -1.2092 2.0629 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6856 0.4680 2.4453 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9246 2.3778 1.9511 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2951 2.5725 -1.8023 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6713 -2.1481 -1.6949 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3192 0.8461 1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3151 4.5136 0.9721 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0286 1.9421 1.1298 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3277 4.6297 -0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0620 -1.6252 -1.8967 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6777 1.3342 1.2179 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5798 -1.5568 -2.3444 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5435 2.3137 -0.7652 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8324 0.5639 -2.4995 H 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 2 8 1 0 0 0 0 2 13 1 0 0 0 0 3 11 2 0 0 0 0 4 7 1 0 0 0 0 5 7 2 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 7 20 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 8 30 1 0 0 0 0 9 11 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 13 1 0 0 0 0 10 16 2 0 0 0 0 12 15 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 17 2 0 0 0 0 14 18 2 0 0 0 0 14 19 1 0 0 0 0 15 20 1 0 0 0 0 15 23 2 0 0 0 0 16 21 1 0 0 0 0 16 35 1 0 0 0 0 17 22 1 0 0 0 0 17 36 1 0 0 0 0 18 24 1 0 0 0 0 18 37 1 0 0 0 0 19 25 2 0 0 0 0 19 38 1 0 0 0 0 20 26 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 41 1 0 0 0 0 23 28 1 0 0 0 0 23 40 1 0 0 0 0 24 27 2 0 0 0 0 24 42 1 0 0 0 0 25 27 1 0 0 0 0 25 43 1 0 0 0 0 26 29 1 0 0 0 0 26 44 1 0 0 0 0 28 29 2 0 0 0 0 28 45 1 0 0 0 0 29 46 1 0 0 0 0 M CHG 2 4 -1 7 1 M END $$$$