BLAG70 -OEChem-04012117432D 44 47 0 0 0 0 0 0 0999 V2000 5.8716 -0.4127 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.0929 2.8862 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.8530 2.6075 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.1807 0.5384 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1249 3.5856 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5896 1.9383 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6807 -1.0005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4897 -0.4127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1807 0.5384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5929 1.3474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6807 -2.0005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4407 -0.7217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5929 1.3474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9019 2.2984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2839 2.2984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8146 -2.5005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5467 -2.5005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6486 -1.6998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1839 -0.0526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8146 -3.5005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5467 -3.5005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5997 -2.0089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1349 -0.3616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6807 -4.0005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3428 -1.3397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3328 2.6075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0609 3.5856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2284 0.8458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2777 -2.1905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0836 -2.1905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1879 -2.1147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0550 0.5539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2777 -3.8105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0836 -3.8105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7286 -2.6153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5957 0.0533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6807 -4.6205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9325 -1.5313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6673 3.4567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1898 4.1921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4544 3.7145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5352 3.7772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5856 4.0005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.1299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 9 1 0 0 0 0 2 14 1 0 0 0 0 2 15 1 0 0 0 0 3 14 1 0 0 0 0 3 27 1 0 0 0 0 4 8 1 0 0 0 0 4 9 2 0 0 0 0 5 26 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 6 26 2 0 0 0 0 6 44 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 13 1 0 0 0 0 10 14 2 0 0 0 0 11 16 2 0 0 0 0 11 17 1 0 0 0 0 12 18 2 0 0 0 0 12 19 1 0 0 0 0 13 15 2 0 0 0 0 13 28 1 0 0 0 0 15 26 1 0 0 0 0 16 20 1 0 0 0 0 16 29 1 0 0 0 0 17 21 2 0 0 0 0 17 30 1 0 0 0 0 18 22 1 0 0 0 0 18 31 1 0 0 0 0 19 23 2 0 0 0 0 19 32 1 0 0 0 0 20 24 2 0 0 0 0 20 33 1 0 0 0 0 21 24 1 0 0 0 0 21 34 1 0 0 0 0 22 25 2 0 0 0 0 22 35 1 0 0 0 0 23 25 1 0 0 0 0 23 36 1 0 0 0 0 24 37 1 0 0 0 0 25 38 1 0 0 0 0 27 39 1 0 0 0 0 27 40 1 0 0 0 0 27 41 1 0 0 0 0 M END $$$$