BT5KR3 -OEChem-04042107013D 40 39 0 1 0 0 0 0 0999 V2000 2.7818 -1.8422 0.9233 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2646 -1.8264 -1.3328 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6140 1.1991 -1.1806 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7314 0.9083 2.0374 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2422 -0.3334 -1.3162 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4002 -1.5709 0.3898 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0162 -0.2003 0.0313 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7374 -0.1853 -0.3979 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2580 0.9455 0.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6240 1.5336 0.0955 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 -0.6645 0.0388 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5267 2.1157 -1.3178 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1134 2.6127 1.0624 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6844 -1.3729 -0.3542 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7875 0.2251 -0.4534 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2571 0.4733 -0.2747 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.5918 1.5311 0.7664 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3424 -0.5815 -0.3288 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6484 -2.9668 1.1025 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6849 0.1473 -1.4397 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3362 0.5884 1.5444 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5186 1.7569 0.5293 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3753 0.7347 0.0894 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2828 -0.7347 1.1323 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1511 -1.6699 -0.3591 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7006 2.8301 -1.4017 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3871 1.3341 -2.0701 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4509 2.6417 -1.5822 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4176 3.4578 1.0981 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0955 2.9924 0.7617 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2065 2.2081 2.0756 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0474 -1.0073 0.6487 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1593 0.9377 -1.2627 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5355 2.0310 0.5247 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7974 2.2815 0.8351 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6355 -3.2405 2.1608 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6723 -2.7041 0.8201 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2908 -3.8178 0.5151 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9454 1.6094 2.6763 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9328 -1.0285 -1.3644 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 19 1 0 0 0 0 2 14 2 0 0 0 0 3 15 2 0 0 0 0 4 17 1 0 0 0 0 4 39 1 0 0 0 0 5 18 1 0 0 0 0 5 40 1 0 0 0 0 6 18 2 0 0 0 0 7 15 1 0 0 0 0 7 16 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 14 1 0 0 0 0 8 20 1 0 0 0 0 9 10 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 10 23 1 0 0 0 0 11 15 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 33 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 M END $$$$