BF8WB1 -OEChem-04012112212D 39 42 0 0 0 0 0 0 0999 V2000 5.5443 0.7368 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.5415 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.4585 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.5415 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.8289 -3.2913 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1299 -1.7066 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9598 -0.8994 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7734 -0.7168 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5443 2.3462 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6279 0.6755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6166 0.5724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8229 -0.4061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1279 1.5415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2228 -0.2323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8518 -1.8936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1279 1.5415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3609 1.2403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5177 -0.0489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3115 0.9296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.0415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.0415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9369 -2.2971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4682 -0.3596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.5415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.5415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.0415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.0415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7105 1.7536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0202 2.1521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6161 -0.3602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9998 -2.4956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4705 -1.8524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2331 1.8469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7729 1.3437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2756 -0.9489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0575 -0.5522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6608 0.2298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 0.7315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2617 -3.5415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 21 1 0 0 0 0 2 24 1 0 0 0 0 3 25 1 0 0 0 0 4 26 1 0 0 0 0 5 22 1 0 0 0 0 5 39 1 0 0 0 0 6 22 2 0 0 0 0 7 12 1 0 0 0 0 7 14 1 0 0 0 0 7 15 1 0 0 0 0 8 12 1 0 0 0 0 8 18 2 0 0 0 0 9 16 2 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 10 14 2 0 0 0 0 11 12 2 0 0 0 0 11 17 1 0 0 0 0 13 16 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 14 30 1 0 0 0 0 15 22 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 17 19 2 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 24 2 0 0 0 0 21 25 2 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 24 26 1 0 0 0 0 25 27 1 0 0 0 0 26 27 2 0 0 0 0 27 38 1 0 0 0 0 M END $$$$