BJK61Q -OEChem-04022106203D 48 50 0 0 0 0 0 0 0999 V2000 0.1801 0.6007 -0.4956 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.5308 1.3213 0.7832 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9603 -3.7520 -0.5672 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3033 -2.3066 1.1980 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7752 -0.2161 -0.5863 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4923 1.8590 0.1584 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0355 0.2491 -0.3115 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8323 1.5462 0.1517 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8883 0.7811 -0.2894 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4699 -1.5342 -1.1001 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2975 -0.3354 -0.4247 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9424 2.3206 0.5286 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4161 2.2244 0.0559 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9312 2.3191 -0.0328 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3912 0.4498 -0.0451 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2190 1.7543 0.4233 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4538 -0.8471 0.3317 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7806 0.8934 0.4181 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3250 0.0230 -0.3235 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2431 -2.5408 -0.0013 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1814 -0.4120 0.7025 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6519 1.7635 -0.2372 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9242 1.3283 -0.6081 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8617 -2.2486 0.6478 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6918 -0.4203 -0.7302 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7179 -4.8205 0.3536 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3118 -1.8613 -1.7189 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5864 -1.4743 -1.7414 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4374 -1.3484 -0.7841 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8191 3.3351 0.8939 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0394 3.0112 -0.5539 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1046 2.3633 1.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2222 2.2166 -1.0873 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2460 3.3064 0.3253 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3939 0.0355 -0.1155 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0885 2.3399 0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4936 -1.0813 1.2135 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3895 2.7947 -0.4536 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5929 2.0206 -1.1128 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0642 -2.7975 1.1608 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0933 -2.7993 -0.2697 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7351 -2.2566 1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2455 0.3808 -1.2322 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2775 -0.7175 0.1457 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6326 -1.2594 -1.4309 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6041 -4.9969 0.9707 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8499 -4.5915 0.9792 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5062 -5.7248 -0.2231 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 13 1 0 0 0 0 2 14 1 0 0 0 0 2 18 1 0 0 0 0 3 20 1 0 0 0 0 3 26 1 0 0 0 0 4 20 2 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 6 8 1 0 0 0 0 6 9 2 0 0 0 0 7 8 1 0 0 0 0 7 11 2 0 0 0 0 8 12 2 0 0 0 0 10 20 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 15 1 0 0 0 0 11 29 1 0 0 0 0 12 16 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 17 19 2 0 0 0 0 17 21 1 0 0 0 0 17 24 1 0 0 0 0 18 21 2 0 0 0 0 18 22 1 0 0 0 0 19 23 1 0 0 0 0 19 25 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 M END $$$$