BJE40I -OEChem-04042102493D 42 44 0 0 0 0 0 0 0999 V2000 0.9214 2.1024 1.7337 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.6624 -2.7573 1.4439 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.7433 -1.2321 0.3332 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.3204 -2.5104 -0.6891 F 0 0 0 0 0 0 0 0 0 0 0 0 0.4301 3.4347 1.4354 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3875 1.7893 3.0709 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4259 1.7545 -2.4718 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1204 1.6800 0.5747 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8551 2.1212 -0.7530 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5722 0.1550 -1.6965 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3836 0.9737 1.3387 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1194 1.0972 0.1602 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5234 0.3086 0.4721 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6679 -0.0577 2.2338 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4242 -0.8420 0.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1397 0.1893 -0.1231 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2336 -0.4234 -0.6761 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6882 -0.9655 1.9504 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6519 -1.7695 -0.7281 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2077 -0.2593 1.5496 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3404 -2.3410 0.3555 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5146 -1.8133 0.4693 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6168 -1.5857 1.4915 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3602 -2.5070 -1.8835 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4975 2.3796 -1.9697 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6789 -1.9138 -2.9365 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3105 -0.5915 -2.7938 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9130 3.5843 -2.6638 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0655 2.1736 -0.3261 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1106 -0.1837 3.1572 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7501 0.2202 -1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 -1.7625 2.6599 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4493 0.3239 2.4335 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1037 2.7587 -0.5058 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6660 -3.3783 0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1530 -2.0295 2.3247 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6624 -3.5483 -1.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4447 -2.4692 -3.8369 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7744 -0.0747 -3.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4220 3.7458 -3.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0419 4.4709 -2.0367 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1519 3.4218 -2.8531 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 2 0 0 0 0 1 6 2 0 0 0 0 1 8 1 0 0 0 0 1 11 1 0 0 0 0 2 22 1 0 0 0 0 3 22 1 0 0 0 0 4 22 1 0 0 0 0 7 25 2 0 0 0 0 8 13 1 0 0 0 0 8 29 1 0 0 0 0 9 12 1 0 0 0 0 9 25 1 0 0 0 0 9 34 1 0 0 0 0 10 17 1 0 0 0 0 10 27 2 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 16 1 0 0 0 0 13 17 1 0 0 0 0 13 20 2 0 0 0 0 14 18 2 0 0 0 0 14 30 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 15 22 1 0 0 0 0 16 31 1 0 0 0 0 17 19 2 0 0 0 0 18 32 1 0 0 0 0 19 21 1 0 0 0 0 19 24 1 0 0 0 0 20 23 1 0 0 0 0 20 33 1 0 0 0 0 21 23 2 0 0 0 0 21 35 1 0 0 0 0 23 36 1 0 0 0 0 24 26 2 0 0 0 0 24 37 1 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 38 1 0 0 0 0 27 39 1 0 0 0 0 28 40 1 0 0 0 0 28 41 1 0 0 0 0 28 42 1 0 0 0 0 M END $$$$