LD3WB6 -OEChem-05032300153D 54 58 0 0 0 0 0 0 0999 V2000 -6.7901 2.5741 1.0439 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4603 2.4346 -1.1994 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1296 -4.3412 0.8679 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0330 3.5041 0.6943 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4945 1.2847 0.0087 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7155 0.5409 -0.6694 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7822 -0.3336 -0.4882 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8541 1.3805 0.0451 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -4.6017 0.6269 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4012 -3.1889 -1.3245 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1005 4.5456 1.1046 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4675 5.9982 1.0197 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4281 5.4316 0.0974 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5551 2.2836 0.3092 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2482 1.9875 0.2104 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9097 0.5956 -0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5372 0.2726 -0.3371 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1745 -0.9854 -0.1468 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0951 0.0046 -0.3775 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5406 -0.7893 -0.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5105 1.1908 -0.6576 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9814 1.1759 -0.9661 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7190 -2.2759 0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2463 -0.7197 -0.5874 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4775 -1.8235 -0.2564 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2881 0.1739 -0.3138 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6447 -3.3201 0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8069 1.4811 0.2812 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0023 -3.0952 0.0769 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0840 2.2121 -0.0557 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3315 -2.0788 -0.9932 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1102 -5.0234 0.8823 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1705 -6.4953 1.2059 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5384 4.2699 1.9928 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4271 6.2638 0.5935 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1326 6.6522 1.8153 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3939 5.6999 0.2741 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6911 5.3204 -0.9474 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0379 3.6223 0.7638 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4531 2.6836 0.4396 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4542 2.2470 -0.8869 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5304 0.5206 -1.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7701 2.0986 -1.5209 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3400 -2.3918 0.3535 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5360 -1.6586 -0.4268 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3544 0.0023 -0.3588 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0721 0.5563 0.8043 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2249 2.1105 0.9644 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7165 -3.9116 0.1622 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9283 -5.3113 0.6875 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6228 3.0363 0.8086 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 -6.7969 1.3679 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4047 -6.6975 2.1137 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2411 -7.0754 0.3751 H 0 0 0 0 0 0 0 0 0 0 0 0 1 30 1 0 0 0 0 1 51 1 0 0 0 0 2 30 2 0 0 0 0 3 32 2 0 0 0 0 4 11 1 0 0 0 0 4 14 1 0 0 0 0 4 39 1 0 0 0 0 5 8 1 0 0 0 0 5 14 1 0 0 0 0 5 19 1 0 0 0 0 6 20 1 0 0 0 0 6 21 1 0 0 0 0 6 22 1 0 0 0 0 7 16 2 0 0 0 0 7 19 1 0 0 0 0 8 26 2 0 0 0 0 9 27 1 0 0 0 0 9 32 1 0 0 0 0 9 50 1 0 0 0 0 10 31 3 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 21 2 0 0 0 0 18 20 2 0 0 0 0 18 23 1 0 0 0 0 19 24 2 0 0 0 0 20 25 1 0 0 0 0 21 41 1 0 0 0 0 22 28 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 27 2 0 0 0 0 23 44 1 0 0 0 0 24 26 1 0 0 0 0 24 31 1 0 0 0 0 25 29 2 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 27 29 1 0 0 0 0 28 30 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 32 33 1 0 0 0 0 33 52 1 0 0 0 0 33 53 1 0 0 0 0 33 54 1 0 0 0 0 M END $$$$