BE3YW2 -OEChem-04022101302D 61 66 0 1 0 0 0 0 0999 V2000 9.1087 2.5843 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.9737 -0.6867 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6058 1.6234 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6040 1.6717 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.3142 0.4694 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9331 2.2287 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6720 2.3068 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5814 1.4600 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.9032 0.4694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2843 2.2287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9237 0.2607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6087 1.0454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2997 1.9965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6087 1.0454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9177 1.9965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2937 0.2607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9320 0.9312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9804 -0.2763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6361 1.4600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9547 1.1428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9594 -0.0722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6256 -0.8179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2721 0.8777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2827 0.4023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6046 -0.6138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6493 2.0951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2510 1.0818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2847 -1.8022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9173 0.3361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3105 -1.3797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3053 0.6140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9727 -2.5843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9924 -2.3716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.5662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9185 2.5732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3932 2.0508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2895 0.3815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8848 -0.1503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5239 2.8006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 2.5627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6974 -0.3165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4537 -0.0611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4147 2.2621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6976 0.3572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4565 0.6006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4534 -0.6028 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2105 -0.8521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2420 1.5913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4720 -0.1881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0660 2.5542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4449 1.6707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6764 -1.9217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5242 0.4627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9159 -1.2462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8887 0.1548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7766 -3.1724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4073 -2.8324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 1.6974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5074 2.3794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1123 3.1622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3296 2.7671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 15 1 0 0 0 0 2 16 2 0 0 0 0 3 23 1 0 0 0 0 3 35 1 0 0 0 0 4 8 1 0 0 0 0 4 17 1 0 0 0 0 4 43 1 0 0 0 0 5 16 1 0 0 0 0 5 18 1 0 0 0 0 5 19 1 0 0 0 0 6 15 1 0 0 0 0 6 19 2 0 0 0 0 7 26 1 0 0 0 0 7 34 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 36 1 0 0 0 0 9 11 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 13 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 20 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 21 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 48 1 0 0 0 0 20 24 1 0 0 0 0 20 26 2 0 0 0 0 21 22 1 0 0 0 0 21 23 2 0 0 0 0 22 25 1 0 0 0 0 22 28 2 0 0 0 0 23 27 1 0 0 0 0 24 31 2 0 0 0 0 24 49 1 0 0 0 0 25 29 1 0 0 0 0 25 30 2 0 0 0 0 26 50 1 0 0 0 0 27 29 2 0 0 0 0 27 51 1 0 0 0 0 28 32 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 30 33 1 0 0 0 0 30 54 1 0 0 0 0 31 34 1 0 0 0 0 31 55 1 0 0 0 0 32 33 2 0 0 0 0 32 56 1 0 0 0 0 33 57 1 0 0 0 0 34 58 1 0 0 0 0 35 59 1 0 0 0 0 35 60 1 0 0 0 0 35 61 1 0 0 0 0 M END $$$$