D08QJS -OEChem-04152110102D 45 45 0 1 0 0 0 0 0999 V2000 4.4594 5.1200 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 5.5870 11.2181 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 8.4629 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8614 2.6200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 11.4629 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4594 4.1200 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.7274 4.1200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2764 8.6581 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 1.7320 10.4629 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 11.4629 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 12.9629 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2764 10.2676 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8600 9.4629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3301 9.9629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3301 8.9629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4641 10.4629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4641 8.4629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5870 7.7076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 9.9629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 8.9629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 11.9629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5934 2.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7274 2.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4594 2.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7274 1.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4594 1.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5934 0.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5934 3.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8888 10.3638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3208 9.0482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3208 9.8776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4641 11.0829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4641 7.8429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9977 7.5150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7796 7.1183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1763 7.9002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1937 11.3460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 7.8429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9964 2.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1905 0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9964 0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5934 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3291 13.2729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 13.2729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3244 2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2 12 1 0 0 0 0 2 37 1 0 0 0 0 3 20 1 0 0 0 0 3 38 1 0 0 0 0 4 23 1 0 0 0 0 4 45 1 0 0 0 0 5 21 2 0 0 0 0 6 28 1 0 0 0 0 7 28 2 0 0 0 0 8 13 1 0 0 0 0 8 15 1 0 0 0 0 8 18 1 0 0 0 0 9 10 2 0 0 0 0 9 19 1 0 0 0 0 10 21 1 0 0 0 0 11 21 1 0 0 0 0 11 43 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 29 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 15 17 2 0 0 0 0 16 19 1 0 0 0 0 16 32 1 0 0 0 0 17 20 1 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 22 28 1 0 0 0 0 23 25 2 0 0 0 0 24 26 1 0 0 0 0 24 39 1 0 0 0 0 25 27 1 0 0 0 0 25 40 1 0 0 0 0 26 27 2 0 0 0 0 26 41 1 0 0 0 0 27 42 1 0 0 0 0 M CHG 2 1 1 6 -1 M END $$$$