BJUQ13 -OEChem-04022111203D 32 35 0 0 0 0 0 0 0999 V2000 0.0369 3.0624 -0.1080 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.5842 -2.2256 -1.8565 F 0 0 0 0 0 0 0 0 0 0 0 0 2.5096 3.6252 -0.6741 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3797 0.8596 -0.3246 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0586 0.3425 0.4163 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0119 1.5966 0.5509 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0923 -0.8756 0.2388 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 0.3035 0.1666 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3982 -0.4956 -0.0765 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1080 1.3610 -0.1796 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8332 -2.2282 0.5387 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4625 -1.4036 -0.1072 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7378 2.7263 -0.3634 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6634 1.4934 0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8881 -3.1476 0.5117 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1818 -2.7395 0.1935 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9738 0.6111 0.3384 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7944 -0.3323 -0.6734 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1160 0.5676 1.1381 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7570 -1.3192 -0.8856 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0787 -0.4192 0.9257 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8991 -1.3628 -0.0859 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1898 1.4081 -0.5782 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8299 -2.5613 0.7883 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4701 -1.0869 -0.3548 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6942 -4.1918 0.7419 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9862 -3.4704 0.1785 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3868 2.5102 0.7884 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9287 -0.3118 -1.3296 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2667 1.2967 1.9301 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9679 -0.4534 1.5483 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6483 -2.1314 -0.2511 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 2 20 1 0 0 0 0 3 13 2 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 4 23 1 0 0 0 0 5 8 1 0 0 0 0 5 14 2 0 0 0 0 6 14 1 0 0 0 0 6 17 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 11 2 0 0 0 0 8 10 2 0 0 0 0 9 12 2 0 0 0 0 10 13 1 0 0 0 0 11 15 1 0 0 0 0 11 24 1 0 0 0 0 12 16 1 0 0 0 0 12 25 1 0 0 0 0 15 16 2 0 0 0 0 15 26 1 0 0 0 0 16 27 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 18 29 1 0 0 0 0 19 21 2 0 0 0 0 19 30 1 0 0 0 0 20 22 2 0 0 0 0 21 22 1 0 0 0 0 21 31 1 0 0 0 0 22 32 1 0 0 0 0 M END $$$$