BA4RP8 -OEChem-04022106492D 46 49 0 0 0 0 0 0 0999 V2000 7.0198 3.6949 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.8858 -0.8051 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5789 -1.1370 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2460 -0.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0722 -2.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1538 -0.8051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0507 -1.7938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5847 -1.0290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9942 -1.8360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0198 -0.3051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0398 0.5785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7615 -2.9506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7186 -2.5381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0198 0.6949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8858 1.1949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4294 -3.6949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4079 -3.4887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.7281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8858 2.1949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1538 1.1949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7798 0.6602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0198 2.6949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1538 2.1949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7798 2.7295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6858 1.1741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6858 2.2157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7577 -0.4337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0284 -0.7553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8212 -2.4314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5505 -2.1098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6464 0.7064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9119 1.1852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4331 0.4506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1549 -3.0784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3252 -2.4103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2368 -4.2842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8220 -3.9501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0669 -1.1117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3836 -1.6611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9331 -2.3444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6168 0.8849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7726 0.0403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6168 2.5049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7726 3.3495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2216 0.8620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2216 2.5278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 2 10 2 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 8 1 0 0 0 0 4 6 2 0 0 0 0 4 11 1 0 0 0 0 5 7 1 0 0 0 0 5 12 2 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 13 2 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 18 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 14 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 16 1 0 0 0 0 12 34 1 0 0 0 0 13 17 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 20 2 0 0 0 0 15 19 1 0 0 0 0 15 21 2 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 22 1 0 0 0 0 19 24 2 0 0 0 0 20 23 1 0 0 0 0 20 41 1 0 0 0 0 21 25 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 23 43 1 0 0 0 0 24 26 1 0 0 0 0 24 44 1 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 M END $$$$