B5QB6R -OEChem-04022102462D 33 35 0 0 0 0 0 0 0999 V2000 5.6602 0.2003 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0421 0.2003 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3511 1.1514 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8511 -1.3874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7634 1.9604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8511 -0.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3511 1.1514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8511 -3.3874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 3.5784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7172 -1.8874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9851 -1.8874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1701 2.8739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7688 1.8559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7172 -2.8874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9851 -2.8874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 3.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 2.6649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8511 -4.3874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.3874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2541 -1.5774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4482 -1.5774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7867 2.9388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 1.2895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2541 -3.1974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4482 -3.1974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8345 4.2494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5644 2.6001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2311 -4.3874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8511 -5.0075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4711 -4.3874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5016 4.7519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6356 4.8890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4984 4.0230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 6 1 0 0 0 0 2 6 2 0 0 0 0 2 7 1 0 0 0 0 3 7 2 0 0 0 0 4 6 1 0 0 0 0 4 10 2 0 0 0 0 4 11 1 0 0 0 0 5 7 1 0 0 0 0 5 12 2 0 0 0 0 5 13 1 0 0 0 0 8 14 2 0 0 0 0 8 15 1 0 0 0 0 8 18 1 0 0 0 0 9 16 2 0 0 0 0 9 17 1 0 0 0 0 9 19 1 0 0 0 0 10 14 1 0 0 0 0 10 20 1 0 0 0 0 11 15 2 0 0 0 0 11 21 1 0 0 0 0 12 16 1 0 0 0 0 12 22 1 0 0 0 0 13 17 2 0 0 0 0 13 23 1 0 0 0 0 14 24 1 0 0 0 0 15 25 1 0 0 0 0 16 26 1 0 0 0 0 17 27 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 19 31 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 M END $$$$