BLA1Y0 -OEChem-04022108282D 53 56 0 1 0 0 0 0 0999 V2000 8.6218 0.9713 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.6208 -0.8427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6208 -4.3532 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6218 0.9752 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6218 0.9674 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3423 3.9780 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 -2.0980 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6097 -3.0980 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 -3.0980 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6180 1.9713 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3479 -2.5980 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.8777 -2.0980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8777 -3.0980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3479 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9315 -1.7932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9315 -3.4027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7437 -1.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -1.7889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7437 -3.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -3.4070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6097 -2.0980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7276 -0.5564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6257 -0.0287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5197 -1.5911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0691 -0.8379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7437 -4.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0691 -4.3580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5278 -0.5495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.5102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4821 2.4746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4782 3.4746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0662 -2.0457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1872 -0.2527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0531 -1.9073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6588 -1.0295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2607 -0.2482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4794 -0.6463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1237 -4.5980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7437 -5.2180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3637 -4.5980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4794 -4.5496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2607 -4.9477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6588 -4.1664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0659 -0.2416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3644 -1.0086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4984 -1.1457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6356 -2.0118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0798 2.2792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6964 1.8928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0922 2.5846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2639 4.0564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8681 3.3646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3399 4.5980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 10 1 0 0 0 0 1 23 1 0 0 0 0 2 15 2 0 0 0 0 3 16 2 0 0 0 0 6 31 1 0 0 0 0 6 53 1 0 0 0 0 7 9 1 0 0 0 0 7 18 1 0 0 0 0 7 29 1 0 0 0 0 8 19 1 0 0 0 0 8 21 2 0 0 0 0 9 20 2 0 0 0 0 10 30 1 0 0 0 0 10 48 1 0 0 0 0 11 14 1 0 0 0 0 11 15 1 0 0 0 0 11 16 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 17 2 0 0 0 0 13 16 1 0 0 0 0 13 19 2 0 0 0 0 14 18 2 0 0 0 0 14 20 1 0 0 0 0 17 21 1 0 0 0 0 17 22 1 0 0 0 0 18 25 1 0 0 0 0 19 26 1 0 0 0 0 20 27 1 0 0 0 0 21 24 1 0 0 0 0 22 23 2 0 0 0 0 22 33 1 0 0 0 0 23 28 1 0 0 0 0 24 28 2 0 0 0 0 24 34 1 0 0 0 0 25 35 1 0 0 0 0 25 36 1 0 0 0 0 25 37 1 0 0 0 0 26 38 1 0 0 0 0 26 39 1 0 0 0 0 26 40 1 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 27 43 1 0 0 0 0 28 44 1 0 0 0 0 29 45 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 30 31 1 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 31 51 1 0 0 0 0 31 52 1 0 0 0 0 M END $$$$