LBT8V9 -OEChem-05032300052D 49 53 0 0 0 0 0 0 0999 V2000 11.3512 -2.5867 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.8069 -0.7820 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1671 1.8129 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.5390 -3.7820 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0749 0.2180 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6730 -2.2820 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5390 -0.7820 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9409 1.7180 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9718 3.2068 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.3512 -0.9772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4050 -1.2820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4050 -2.2820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9348 -1.7820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5390 -2.7820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6730 -1.2820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8069 -2.7820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9409 -2.2820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8069 -3.7820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8069 0.2180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 2.5499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 3.4160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0749 -2.7820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9409 -4.2820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 3.4160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9409 0.7180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0749 2.2180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 2.5499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 4.2820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0749 -3.7820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 4.2820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.4160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8886 -0.6680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1002 -0.4103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3957 -2.1967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3957 -1.3672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9409 -1.6620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3439 -4.0920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4175 0.1104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0190 0.8006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5379 -2.4720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9409 -4.9020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1900 2.0130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8100 4.8189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5379 -4.0920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4778 2.0280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1900 4.8189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.0360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 3.4160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.7960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 2 15 1 0 0 0 0 2 19 1 0 0 0 0 3 20 1 0 0 0 0 3 26 1 0 0 0 0 4 14 2 0 0 0 0 5 25 2 0 0 0 0 6 14 1 0 0 0 0 6 15 1 0 0 0 0 6 16 1 0 0 0 0 7 11 1 0 0 0 0 7 15 2 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 8 45 1 0 0 0 0 9 21 1 0 0 0 0 9 26 2 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 12 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 17 22 1 0 0 0 0 17 36 1 0 0 0 0 18 23 2 0 0 0 0 18 37 1 0 0 0 0 19 25 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 27 1 0 0 0 0 21 28 1 0 0 0 0 22 29 2 0 0 0 0 22 40 1 0 0 0 0 23 29 1 0 0 0 0 23 41 1 0 0 0 0 24 27 2 0 0 0 0 24 30 1 0 0 0 0 24 31 1 0 0 0 0 27 42 1 0 0 0 0 28 30 2 0 0 0 0 28 43 1 0 0 0 0 29 44 1 0 0 0 0 30 46 1 0 0 0 0 31 47 1 0 0 0 0 31 48 1 0 0 0 0 31 49 1 0 0 0 0 M END $$$$