BX8R9I -OEChem-04022101502D 38 39 0 1 0 0 0 0 0999 V2000 3.7320 -4.4625 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.5686 2.5320 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.4625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3657 4.4625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.0375 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3776 1.1308 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9480 3.7580 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.4625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8660 0.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.4625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.4625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.4625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.5375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5468 2.7399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 1.8739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9535 3.6535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.1575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 1.0375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.6575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 1.0375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 0.0744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.7725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -0.9994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.6525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -1.6525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 1.3475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -3.2725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -3.2725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6634 1.8091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2002 4.3244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3125 3.2564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 2 19 1 0 0 0 0 2 20 1 0 0 0 0 3 13 2 0 0 0 0 4 22 2 0 0 0 0 5 13 1 0 0 0 0 5 19 1 0 0 0 0 5 33 1 0 0 0 0 6 19 2 0 0 0 0 6 21 1 0 0 0 0 7 22 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 6 0 0 0 8 23 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 9 24 1 0 0 0 0 10 14 2 0 0 0 0 10 15 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 14 16 1 0 0 0 0 14 31 1 0 0 0 0 15 17 2 0 0 0 0 15 32 1 0 0 0 0 16 18 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 36 1 0 0 0 0 M END $$$$