B47VLT -OEChem-04022103042D 49 49 0 1 0 0 0 0 0999 V2000 2.0000 0.9300 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 14.5696 2.1001 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 14.5696 -2.2400 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 12.4725 0.7348 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4725 -0.8747 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.9300 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7606 -1.6523 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 13.7606 1.5124 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 14.8596 -0.7623 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8596 0.6224 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.9300 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.4300 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.9282 0.9300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 0.4300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.4300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.5700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.9300 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.6603 0.9300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 0.4300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.5700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -0.5700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0561 -0.0700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.4300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -1.0700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.9300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.5700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8651 -0.6577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8651 0.5178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.4300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.0700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.0500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3267 1.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5297 1.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.5500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9316 -0.0449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7287 -0.0449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4422 -0.5700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6822 -0.5700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.2401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 1.5500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2573 -0.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -1.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.5500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 2.2400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -0.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 4 19 1 0 0 0 0 4 22 1 0 0 0 0 5 21 1 0 0 0 0 5 22 1 0 0 0 0 17 6 1 1 0 0 0 6 47 1 0 0 0 0 7 27 1 0 0 0 0 8 28 1 0 0 0 0 9 27 2 0 0 0 0 10 28 2 0 0 0 0 12 11 1 1 0 0 0 11 15 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 18 2 0 0 0 0 14 20 1 0 0 0 0 15 17 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 23 1 0 0 0 0 17 41 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 20 24 2 0 0 0 0 20 43 1 0 0 0 0 21 24 1 0 0 0 0 22 27 1 0 0 0 0 22 28 1 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 24 44 1 0 0 0 0 25 29 1 0 0 0 0 25 45 1 0 0 0 0 26 30 2 0 0 0 0 26 46 1 0 0 0 0 29 31 2 0 0 0 0 30 31 1 0 0 0 0 30 48 1 0 0 0 0 31 49 1 0 0 0 0 M CHG 4 2 1 3 1 7 -1 8 -1 M END $$$$