BX5R2T -OEChem-04022117243D 30 32 0 0 0 0 0 0 0999 V2000 -4.1981 1.0299 0.4253 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5480 -1.6326 -0.0178 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9492 -0.7087 -0.0827 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6279 -2.2658 -0.2504 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2398 -0.0439 0.0755 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2089 -1.0376 -0.0334 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2269 -0.1529 -0.0557 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5418 1.3001 0.2976 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5647 -0.6877 0.0836 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6652 -2.0322 -0.2741 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8911 0.6558 0.3068 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8961 1.6304 0.4118 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2988 -0.9175 0.3884 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4148 1.1580 -0.4766 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5784 -0.3625 0.4125 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6944 1.7129 -0.4527 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7761 0.9525 -0.0082 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8873 1.4018 -0.7497 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1939 2.0768 0.4555 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4177 -2.7909 -0.4452 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1712 2.6658 0.6015 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1798 -1.9380 0.7413 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6391 1.7578 -0.9373 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4205 -0.9530 0.7615 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8537 2.7282 -0.8042 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7731 1.3829 0.0057 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1221 -2.4939 -0.1718 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4198 2.2766 -1.2129 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9157 1.6607 -0.4827 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9141 0.5736 -1.4652 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 18 1 0 0 0 0 2 9 1 0 0 0 0 2 27 1 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 3 10 1 0 0 0 0 4 6 1 0 0 0 0 4 10 2 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 9 1 0 0 0 0 7 13 2 0 0 0 0 7 14 1 0 0 0 0 8 12 2 0 0 0 0 8 19 1 0 0 0 0 9 11 2 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 12 21 1 0 0 0 0 13 15 1 0 0 0 0 13 22 1 0 0 0 0 14 16 2 0 0 0 0 14 23 1 0 0 0 0 15 17 2 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 17 26 1 0 0 0 0 18 28 1 0 0 0 0 18 29 1 0 0 0 0 18 30 1 0 0 0 0 M END $$$$