D00693 -OEChem-05072122023D 44 45 0 1 0 0 0 0 0999 V2000 -1.2421 1.4059 1.6782 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5426 -0.4131 -1.6077 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3974 -2.3616 0.0088 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5979 -0.0487 -0.2112 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.6980 1.0757 0.3899 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.0394 0.4487 -0.4414 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7842 2.3543 -0.4812 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0802 1.7118 -1.2951 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2237 2.8207 -0.6986 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6466 -1.3078 0.6675 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7637 0.6314 0.5226 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4939 0.3076 -0.6172 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3514 0.5554 1.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4472 -3.5662 0.8432 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8140 -2.6794 -1.2981 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8237 -0.0960 -0.4964 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6810 0.1520 1.9027 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4173 -0.1735 0.7636 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8969 -0.8170 -1.4117 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1682 -0.2798 -1.1919 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5286 0.6499 0.5204 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6455 -0.3123 -0.9455 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3267 2.1932 -1.4649 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2269 3.1721 -0.0057 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1155 2.0584 -1.3901 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7274 1.4800 -2.3077 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2294 3.6888 -1.3677 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6578 3.1526 0.2522 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1192 -1.0652 1.6278 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6310 -1.6550 0.8938 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8516 2.2477 1.9695 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0480 0.3569 -1.6066 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8111 0.7945 2.6926 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9045 -3.3426 1.8136 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4510 -3.9881 1.0193 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0714 -4.3348 0.3739 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0392 -1.9175 -2.0502 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2595 -3.5985 -1.6993 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7302 -2.8360 -1.2475 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1423 0.0901 2.8842 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4445 -0.4794 0.9298 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3167 -1.0307 -2.4001 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9605 -1.7431 -0.8303 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4981 -0.0115 -0.9765 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 31 1 0 0 0 0 2 16 1 0 0 0 0 2 19 1 0 0 0 0 3 10 1 0 0 0 0 3 14 1 0 0 0 0 3 15 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 4 20 1 0 0 0 0 5 7 1 0 0 0 0 5 11 1 0 0 0 0 6 8 1 0 0 0 0 6 21 1 0 0 0 0 6 22 1 0 0 0 0 7 9 1 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 12 16 1 0 0 0 0 12 32 1 0 0 0 0 13 17 2 0 0 0 0 13 33 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 18 2 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 M END $$$$