B4PWG9 -OEChem-04022107482D 44 46 0 0 0 0 0 0 0999 V2000 5.1646 -1.8584 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7634 -0.8403 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.1956 4.6825 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 10.1956 3.6825 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.1956 3.6825 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 -2.5629 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4067 -4.1809 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3296 -0.8175 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2251 -1.8120 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2469 -2.0199 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 -2.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 -3.4764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.2674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 -4.2854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1701 -1.7539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1956 -0.3175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7524 -1.0494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1956 0.6825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7469 -1.1539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4160 -0.4108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3296 1.1825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0616 1.1825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1956 2.6825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3296 2.1825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0616 2.1825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1956 3.6825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7587 -1.8624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0305 -2.1866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4197 -3.9224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5030 -3.1297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5693 -2.8214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4860 -3.6141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2304 -4.8814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9585 -4.5572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0423 -4.6825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4077 -0.9001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8062 -0.2098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9233 -0.4534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1952 -0.7776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2872 0.1957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7927 0.8725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5986 0.8725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7927 2.4925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5986 2.4925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 17 1 0 0 0 0 2 15 2 0 0 0 0 3 26 1 0 0 0 0 4 26 1 0 0 0 0 5 26 1 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 6 15 1 0 0 0 0 7 13 1 0 0 0 0 7 14 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 16 1 0 0 0 0 8 20 1 0 0 0 0 9 10 2 0 0 0 0 10 19 1 0 0 0 0 11 13 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 14 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 16 18 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 19 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 21 2 0 0 0 0 18 22 1 0 0 0 0 19 20 2 0 0 0 0 20 40 1 0 0 0 0 21 24 1 0 0 0 0 21 41 1 0 0 0 0 22 25 2 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 M END $$$$