B3HE8Y -OEChem-04022109533D 52 56 0 0 0 0 0 0 0999 V2000 8.3356 2.4307 -0.7513 F 0 0 0 0 0 0 0 0 0 0 0 0 6.6139 3.3010 0.2517 F 0 0 0 0 0 0 0 0 0 0 0 0 8.0144 2.0800 1.3704 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.8831 -0.6161 -0.8646 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1401 0.7577 0.9154 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1510 4.1197 -2.0002 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4065 -1.4544 0.6018 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1962 2.0364 -1.4010 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4892 3.1144 0.1191 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3095 1.4559 1.9238 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7533 -2.4049 -0.0585 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1010 -2.1886 -0.4326 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0656 -1.3006 0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5899 -0.8742 -0.5091 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4368 -0.0016 0.1469 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7620 0.2111 -0.2209 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2644 -3.7193 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2553 1.2689 -0.2404 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9200 -3.2928 -0.7192 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6861 -1.0578 1.2689 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6743 0.0575 0.0475 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8006 -0.6087 0.3607 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3365 -0.4534 0.9144 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0439 1.9196 0.6965 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0922 -4.8047 -0.2701 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4174 -4.5919 -0.6381 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5410 0.5308 0.6754 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9227 -0.4655 1.3149 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5735 0.9459 -0.1655 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0929 -1.3331 -0.7951 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9696 3.2122 -1.2014 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7317 0.2584 2.2005 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8656 0.2217 -1.3214 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1252 -0.9179 -1.6359 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3659 2.1637 0.1712 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1211 0.8999 0.3458 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1304 1.2314 -0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7545 -2.4042 0.6518 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7561 -3.9591 0.2978 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6527 -2.1537 1.2833 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9077 -0.7668 2.3041 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9599 -3.1621 -1.0099 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7025 -5.8166 -0.2073 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0614 -5.4373 -0.8623 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6844 1.7867 -2.2381 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 1.0983 1.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5105 -1.4205 1.6246 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0852 3.7884 0.5831 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5216 -2.2215 -1.0514 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9404 -0.1305 3.1927 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6654 0.5280 -1.9898 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3522 -1.4818 -2.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 35 1 0 0 0 0 2 35 1 0 0 0 0 3 35 1 0 0 0 0 4 14 1 0 0 0 0 4 21 1 0 0 0 0 5 23 2 0 0 0 0 6 31 2 0 0 0 0 7 13 1 0 0 0 0 7 23 1 0 0 0 0 7 38 1 0 0 0 0 8 18 1 0 0 0 0 8 31 1 0 0 0 0 8 45 1 0 0 0 0 9 24 1 0 0 0 0 9 31 1 0 0 0 0 9 48 1 0 0 0 0 10 24 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 2 0 0 0 0 12 14 1 0 0 0 0 12 19 2 0 0 0 0 13 15 2 0 0 0 0 14 16 2 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 17 25 1 0 0 0 0 17 39 1 0 0 0 0 18 21 2 0 0 0 0 18 24 1 0 0 0 0 19 26 1 0 0 0 0 19 42 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 28 1 0 0 0 0 22 27 2 0 0 0 0 22 30 1 0 0 0 0 25 26 2 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 27 29 1 0 0 0 0 27 46 1 0 0 0 0 28 32 2 0 0 0 0 28 47 1 0 0 0 0 29 33 2 0 0 0 0 29 35 1 0 0 0 0 30 34 2 0 0 0 0 30 49 1 0 0 0 0 32 50 1 0 0 0 0 33 34 1 0 0 0 0 33 51 1 0 0 0 0 34 52 1 0 0 0 0 M END $$$$