B1RL4V -OEChem-04022104492D 46 49 0 0 0 0 0 0 0999 V2000 2.4628 -2.6937 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.6069 -4.6057 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9641 -2.9109 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6678 2.8325 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0071 -2.4984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0608 -2.1937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5907 -1.6937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0071 -0.8890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0608 -1.1937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3177 -3.4490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3177 0.0615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1948 -2.6937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1948 -0.6937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5907 -1.6937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6499 0.8058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3288 -2.1937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3288 -1.1937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2962 -3.6552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9605 1.7564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6714 0.5996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3142 2.2944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2927 2.5007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0035 1.3439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6464 3.0387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9570 3.9893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2892 4.7336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.5768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3107 4.5274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7039 -3.5363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2972 -4.0686 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9244 0.1894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1948 -3.3137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1948 -0.0737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5907 -2.3137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2107 -1.6937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5907 -1.0737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7919 -0.8837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5672 1.8842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4788 0.0103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4853 3.0900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3969 1.2161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2136 -4.7336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5637 4.1171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4818 5.3229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3933 3.4490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8966 4.9888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 2 18 1 0 0 0 0 2 42 1 0 0 0 0 3 18 2 0 0 0 0 4 24 1 0 0 0 0 4 27 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 5 10 1 0 0 0 0 6 9 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 8 11 2 0 0 0 0 9 13 1 0 0 0 0 10 18 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 15 1 0 0 0 0 11 31 1 0 0 0 0 12 16 2 0 0 0 0 12 32 1 0 0 0 0 13 17 2 0 0 0 0 13 33 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 19 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 17 37 1 0 0 0 0 19 22 1 0 0 0 0 19 38 1 0 0 0 0 20 23 2 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 28 2 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 28 46 1 0 0 0 0 M END $$$$