BED3J2 -OEChem-04022117253D 26 27 0 1 0 0 0 0 0999 V2000 -2.8108 -1.6591 -0.9200 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5206 2.3286 1.1133 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4546 1.1569 1.3734 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2821 -1.6013 0.2141 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7233 0.2256 -1.2544 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6876 0.2451 -0.7337 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8937 -0.8338 0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2855 -1.0598 -0.6056 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4915 1.4771 -0.8427 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7067 1.1436 -1.0031 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1141 -1.0429 0.7474 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3435 -2.8008 1.0318 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9434 0.9465 -0.3848 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1449 -0.1377 0.4848 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5784 1.6120 0.6536 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7188 0.1068 -2.3443 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 2.3839 -1.2589 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5170 1.4593 -1.2301 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5548 1.9816 -1.6747 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2837 -1.8788 1.4167 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1027 -2.5431 2.0677 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3781 -3.5301 0.6514 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -3.2485 1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7590 1.6382 -0.5777 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1147 -0.2739 0.9558 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5448 2.4318 2.0884 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 2 0 0 0 0 2 15 1 0 0 0 0 2 26 1 0 0 0 0 3 15 2 0 0 0 0 4 7 1 0 0 0 0 4 8 1 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 9 1 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 6 10 2 0 0 0 0 7 11 2 0 0 0 0 9 15 1 0 0 0 0 9 17 1 0 0 0 0 9 18 1 0 0 0 0 10 13 1 0 0 0 0 10 19 1 0 0 0 0 11 14 1 0 0 0 0 11 20 1 0 0 0 0 12 21 1 0 0 0 0 12 22 1 0 0 0 0 12 23 1 0 0 0 0 13 14 2 0 0 0 0 13 24 1 0 0 0 0 14 25 1 0 0 0 0 M END $$$$