B8SA2E -OEChem-04022105192D 42 41 0 1 0 0 0 0 0999 V2000 6.7320 0.1825 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 2.0000 1.9145 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 7.5981 0.6825 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2320 -0.6835 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 2.7806 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2320 1.0485 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1340 -1.3175 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 1.9145 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.0000 0.1825 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 0.1825 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8660 -0.3175 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5000 1.0485 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8660 -1.3175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 1.9145 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5000 1.0485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 -1.8175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 1.9145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7320 -1.8175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 -2.8175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5981 1.6825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7320 -2.8175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8660 -3.3175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4641 2.1825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8660 0.3025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1900 0.5116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4631 -0.1275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3800 1.9145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 1.2945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6200 1.9145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 2.5345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2690 -1.5075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8520 -0.6835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4631 -3.1275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3860 2.2651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9875 1.5748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2690 -3.1275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8100 3.3175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8660 -3.9375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7741 1.6456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0010 2.4925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1541 2.7194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5970 -1.6275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 1 6 2 0 0 0 0 1 11 1 0 0 0 0 3 20 1 0 0 0 0 4 32 1 0 0 0 0 14 5 1 6 0 0 0 5 37 1 0 0 0 0 7 16 1 0 0 0 0 7 42 1 0 0 0 0 8 15 1 0 0 0 0 9 15 2 0 0 0 0 10 11 1 0 0 0 0 12 10 1 6 0 0 0 10 26 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 12 25 1 0 0 0 0 13 16 1 0 0 0 0 13 18 2 0 0 0 0 14 17 1 0 0 0 0 14 27 1 0 0 0 0 16 19 2 0 0 0 0 17 28 1 0 0 0 0 17 29 1 0 0 0 0 17 30 1 0 0 0 0 18 21 1 0 0 0 0 18 31 1 0 0 0 0 19 22 1 0 0 0 0 19 33 1 0 0 0 0 20 23 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 M CHG 2 2 1 8 -1 M END $$$$