B5IEV7 -OEChem-04022114463D 42 44 0 0 0 0 0 0 0999 V2000 -4.4882 2.8949 -0.4597 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5536 -0.6145 -0.0888 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8243 -0.5337 0.0135 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1061 -2.5522 -0.2868 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7898 -1.3077 -0.2537 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9490 -0.3632 -0.0959 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2774 0.5163 -1.1277 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6951 -0.3653 1.0827 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0983 1.3912 0.1977 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2970 -1.2649 -0.1551 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3520 1.3935 -0.9808 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7697 0.5118 1.2296 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1977 -0.4800 0.1149 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9740 -1.2307 -0.0634 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2975 -2.6248 -0.3898 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2541 0.8614 -0.2637 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2477 2.3283 0.3542 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3209 -1.0970 0.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4337 1.5858 -0.0913 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9456 -3.2216 -0.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5003 -0.3725 0.8387 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5569 0.9688 0.4598 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7251 3.5761 -0.2543 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8578 -1.7679 -1.2482 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8890 -2.1147 0.4836 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5320 0.3841 0.0854 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7029 0.5274 -2.0502 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4491 -1.0427 1.8961 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5969 2.0751 -1.7911 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3421 0.5021 2.1534 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3951 1.3629 -0.7041 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1797 -3.2342 -0.5304 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3058 -2.1378 0.9802 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9067 3.2709 0.7937 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0219 1.8998 0.9997 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7183 2.5413 -0.6117 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0464 -4.2865 -0.6266 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3737 -0.8530 1.2702 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5039 1.4719 0.6221 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5298 3.1390 -0.8552 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9831 3.6299 0.8089 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5890 4.6052 -0.6025 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 1 23 1 0 0 0 0 2 5 1 0 0 0 0 2 10 1 0 0 0 0 2 26 1 0 0 0 0 3 10 2 0 0 0 0 3 14 1 0 0 0 0 4 14 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 5 25 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 7 11 1 0 0 0 0 7 27 1 0 0 0 0 8 12 2 0 0 0 0 8 28 1 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 9 17 1 0 0 0 0 10 15 1 0 0 0 0 11 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 16 2 0 0 0 0 13 18 1 0 0 0 0 15 20 2 0 0 0 0 15 32 1 0 0 0 0 16 19 1 0 0 0 0 16 31 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 21 2 0 0 0 0 18 33 1 0 0 0 0 19 22 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 M END $$$$