B2TDR1 -OEChem-04022107082D 44 48 0 0 0 0 0 0 0999 V2000 8.7360 0.1637 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.0681 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.3621 -1.3770 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 14.8575 -0.2634 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8575 -1.8729 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3996 -0.4749 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2086 0.9264 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.2305 1.1343 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1646 0.6592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1537 0.8682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9112 -0.5681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9112 -1.5681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1792 -0.5681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1701 0.5546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0452 -0.0681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1482 0.9728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5714 1.5727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7524 -0.1498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5659 1.6772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7469 -0.0453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0452 -2.0681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1792 -1.5681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4411 -1.0681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3132 -0.0681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7634 -0.3589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 1.3637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7305 0.2683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 1.2591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7688 -0.4634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 0.3456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0452 0.5519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7054 1.2445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9773 1.5687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2069 2.0743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5002 -0.7162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8180 2.2436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1114 -0.5469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0452 -2.6881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6423 -1.8781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9019 -1.4829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9019 -0.6534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1278 -0.8605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8345 1.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5644 0.2808 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 27 1 0 0 0 0 2 28 1 0 0 0 0 3 29 1 0 0 0 0 4 11 1 0 0 0 0 4 23 1 0 0 0 0 5 12 1 0 0 0 0 5 23 1 0 0 0 0 6 24 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 24 2 0 0 0 0 8 27 2 0 0 0 0 9 14 1 0 0 0 0 9 17 2 0 0 0 0 9 18 1 0 0 0 0 10 16 1 0 0 0 0 10 19 2 0 0 0 0 10 20 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 21 1 0 0 0 0 13 15 2 0 0 0 0 13 22 1 0 0 0 0 13 24 1 0 0 0 0 14 25 2 0 0 0 0 14 26 1 0 0 0 0 15 31 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 17 19 1 0 0 0 0 17 34 1 0 0 0 0 18 20 2 0 0 0 0 18 35 1 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 25 29 1 0 0 0 0 25 42 1 0 0 0 0 26 28 2 0 0 0 0 26 43 1 0 0 0 0 28 30 1 0 0 0 0 29 30 2 0 0 0 0 30 44 1 0 0 0 0 M END $$$$