B6KJI5 -OEChem-04022112493D 52 54 0 1 0 0 0 0 0999 V2000 6.7641 -2.1574 1.0557 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.7322 2.9564 -0.5293 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -6.9823 -1.6455 -1.7331 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.4763 0.9041 -0.5982 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7021 1.7259 1.8698 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2413 -0.5424 -0.2792 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7055 1.6074 0.2676 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7864 0.5793 -1.7568 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9191 0.3312 0.0281 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5515 -0.9382 0.4930 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9341 -0.6432 0.4873 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.2550 -2.0021 -0.1138 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5166 0.0158 -1.2648 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5897 -0.1326 0.0521 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2116 1.4669 0.7778 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2240 2.4083 0.1737 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2353 -0.6732 0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2230 -1.4495 0.6773 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 -1.2110 0.4265 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8920 0.5362 -0.5406 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8181 -1.7629 -0.6988 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9497 -0.4339 1.3144 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9178 -0.7610 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1740 -1.5380 -0.9361 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3057 -0.2090 1.0773 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9417 0.2612 0.6692 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3674 0.4114 0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2589 -0.6517 0.3701 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8009 1.6144 -0.3313 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5838 -0.5120 -0.0433 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1257 1.7541 -0.7447 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0172 0.6910 -0.6006 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9351 -0.6874 1.5831 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3996 -2.6738 -0.2186 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0187 -2.5094 0.4848 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6064 0.0576 -1.1877 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1784 0.7475 -2.0042 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7642 -1.7659 1.0441 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2012 1.9221 0.1169 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9034 2.7275 -0.8213 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3159 3.2974 0.8049 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4347 -2.3471 1.2545 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2514 -2.3708 -1.3999 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4859 0.0005 2.1969 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6457 -1.9706 -1.8141 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8180 0.3973 1.8158 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9317 -0.2097 1.6617 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4536 1.2325 0.7844 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2912 -1.3306 0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4797 2.6847 -1.1812 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4760 2.4146 -0.2405 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0487 0.7999 -0.9225 H 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 2 29 1 0 0 0 0 3 12 1 0 0 0 0 3 13 1 0 0 0 0 4 14 2 0 0 0 0 5 15 2 0 0 0 0 6 23 1 0 0 0 0 6 26 1 0 0 0 0 7 20 1 0 0 0 0 7 51 1 0 0 0 0 8 20 2 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 9 15 1 0 0 0 0 10 14 1 0 0 0 0 10 17 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 11 33 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 15 16 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 21 24 1 0 0 0 0 21 43 1 0 0 0 0 22 25 2 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 24 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 28 30 1 0 0 0 0 29 31 2 0 0 0 0 30 32 2 0 0 0 0 30 49 1 0 0 0 0 31 32 1 0 0 0 0 31 50 1 0 0 0 0 32 52 1 0 0 0 0 M END $$$$