LDTB40 -OEChem-05022322542D 55 56 0 1 0 0 0 0 0999 V2000 6.8671 0.7327 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.3671 1.5987 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3671 -0.1334 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.7673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 0.2327 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.2327 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 3.4030 0.7327 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.7327 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1350 1.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 1.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 0.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 2.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 1.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 2.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 2.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3591 0.6980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3591 2.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2651 1.2119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2651 2.2535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.1127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.3527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2131 -1.3499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6116 -0.6597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9230 -0.6847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5244 -1.3750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.8873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5790 2.7696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.5427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9590 1.6957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3110 1.6957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 2.5427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6910 2.7696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9590 -2.2304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.0773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5790 -3.3043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6910 -3.3043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 -3.0773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3110 -2.2304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 0.1127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.5427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.3527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 3.3527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3519 0.0780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3519 3.3873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8009 0.8998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8009 2.5656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.5427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 6 1 0 0 0 0 1 16 1 0 0 0 0 4 13 2 0 0 0 0 5 7 1 0 0 0 0 5 55 1 0 0 0 0 8 6 1 1 0 0 0 6 10 1 0 0 0 0 7 13 1 0 0 0 0 7 49 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 28 1 0 0 0 0 9 14 1 0 0 0 0 9 15 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 17 1 0 0 0 0 12 18 1 0 0 0 0 12 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 19 2 0 0 0 0 16 20 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 21 1 0 0 0 0 19 47 1 0 0 0 0 20 23 2 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 24 2 0 0 0 0 22 23 1 0 0 0 0 22 25 2 0 0 0 0 23 50 1 0 0 0 0 24 26 1 0 0 0 0 24 51 1 0 0 0 0 25 27 1 0 0 0 0 25 52 1 0 0 0 0 26 27 2 0 0 0 0 26 53 1 0 0 0 0 27 54 1 0 0 0 0 M END $$$$