B6X4UD -OEChem-04012114562D 21 22 0 0 0 0 0 0 0999 V2000 4.6456 0.9588 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.1344 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.0934 3.0292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3092 1.5975 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8147 2.5680 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.1344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.3656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.8656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8366 2.3601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.6344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.6344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.6344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.6344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 1.7020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.1344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 1.1756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.3244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.3244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0669 3.1344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.9444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.9444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 14 1 0 0 0 0 2 15 1 0 0 0 0 3 9 2 0 0 0 0 4 14 2 0 0 0 0 5 9 1 0 0 0 0 5 14 1 0 0 0 0 5 19 1 0 0 0 0 6 8 1 0 0 0 0 6 10 2 0 0 0 0 6 11 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 8 16 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 11 13 2 0 0 0 0 11 18 1 0 0 0 0 12 15 2 0 0 0 0 12 20 1 0 0 0 0 13 15 1 0 0 0 0 13 21 1 0 0 0 0 M END $$$$