B4I3EY -OEChem-04022101532D 45 48 0 0 0 0 0 0 0999 V2000 4.7320 -0.0530 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 3.9470 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.9470 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 2.9470 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 9.0622 -0.5530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 -0.9190 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2320 0.8131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4580 -2.5530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -0.5530 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.8744 -1.7482 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.8744 -3.3577 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9282 -2.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9282 -3.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 0.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0622 -1.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 -0.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1962 -0.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 1.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 -0.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0622 -3.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 1.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1962 -2.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4580 -2.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1962 -3.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 0.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1962 0.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 1.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 0.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 1.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 2.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -1.1730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0670 -1.1589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 1.7570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0670 -3.9470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 -1.1730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0622 -4.1730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6592 -1.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.6730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6592 -3.3630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9272 1.2570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7331 1.2570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 1.7570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 0.1370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 2.0670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 2 0 0 0 0 1 7 2 0 0 0 0 1 9 1 0 0 0 0 1 14 1 0 0 0 0 2 31 1 0 0 0 0 3 31 1 0 0 0 0 4 31 1 0 0 0 0 5 15 1 0 0 0 0 5 17 1 0 0 0 0 8 24 2 0 0 0 0 9 16 1 0 0 0 0 9 32 1 0 0 0 0 10 12 1 0 0 0 0 10 24 1 0 0 0 0 10 33 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 20 1 0 0 0 0 14 18 1 0 0 0 0 14 23 2 0 0 0 0 15 22 2 0 0 0 0 16 19 2 0 0 0 0 16 26 1 0 0 0 0 17 19 1 0 0 0 0 17 27 2 0 0 0 0 18 21 2 0 0 0 0 18 34 1 0 0 0 0 19 36 1 0 0 0 0 20 25 2 0 0 0 0 20 37 1 0 0 0 0 21 28 1 0 0 0 0 21 31 1 0 0 0 0 22 25 1 0 0 0 0 22 38 1 0 0 0 0 23 29 1 0 0 0 0 23 39 1 0 0 0 0 25 40 1 0 0 0 0 26 30 2 0 0 0 0 26 41 1 0 0 0 0 27 30 1 0 0 0 0 27 42 1 0 0 0 0 28 29 2 0 0 0 0 28 43 1 0 0 0 0 29 44 1 0 0 0 0 30 45 1 0 0 0 0 M END $$$$