B5QEJ4 -OEChem-04012112422D 58 60 0 0 0 0 0 0 0999 V2000 3.4030 -2.4050 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 1.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -3.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -2.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6651 0.5708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6651 2.6192 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 3.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 -3.2710 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 -1.5390 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8950 0.5603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8950 2.6297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 2.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8010 1.0742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8010 2.1158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -2.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -3.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5331 1.0675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6613 3.6191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 3.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8878 -0.0596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0044 0.1201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8015 0.1201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 -0.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8878 3.2496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7924 2.7027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1909 2.0124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2269 -2.3681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8469 -3.4419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.7850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6910 -4.4419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 -4.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3110 -3.3681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0431 -2.4419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2700 -1.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4231 -1.3681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8410 0.5294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0712 1.3754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2252 1.6056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2813 3.6215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6589 4.2391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0413 3.6168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 2 0 0 0 0 1 9 2 0 0 0 0 1 18 1 0 0 0 0 1 28 1 0 0 0 0 2 20 1 0 0 0 0 2 45 1 0 0 0 0 3 24 1 0 0 0 0 3 29 1 0 0 0 0 4 26 1 0 0 0 0 4 30 1 0 0 0 0 5 25 1 0 0 0 0 5 31 1 0 0 0 0 6 27 1 0 0 0 0 6 32 1 0 0 0 0 7 23 1 0 0 0 0 7 46 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 11 14 1 0 0 0 0 11 19 1 0 0 0 0 12 15 2 0 0 0 0 12 20 1 0 0 0 0 13 17 1 0 0 0 0 13 21 2 0 0 0 0 14 16 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 23 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 24 1 0 0 0 0 19 25 2 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 21 26 1 0 0 0 0 21 38 1 0 0 0 0 22 27 2 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 24 26 2 0 0 0 0 25 27 1 0 0 0 0 28 42 1 0 0 0 0 28 43 1 0 0 0 0 28 44 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 M END $$$$