B9HKQ6 -OEChem-04022107082D 37 39 0 0 0 0 0 0 0999 V2000 3.7634 1.7014 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0421 -0.0587 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9851 -5.1465 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1191 -3.6465 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8511 -3.6465 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6602 -0.0587 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3511 0.8924 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8511 -1.6465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 3.4239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1701 2.6149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9851 -2.1465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8511 -0.6465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9851 -3.1465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7172 -2.1465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 4.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 3.3194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3511 0.8924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7172 -3.1465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 5.1465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.1284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4067 5.0420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1191 -4.6465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2531 -5.1465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6841 2.2682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6008 3.0609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4482 -1.8365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2541 -1.8365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6056 4.4023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3356 2.7530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2541 -3.4565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6534 5.7129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 4.0636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5822 -3.3365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0423 5.5436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9431 -4.6096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7161 -5.4565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5631 -5.6834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 17 1 0 0 0 0 2 12 1 0 0 0 0 2 17 1 0 0 0 0 3 22 2 0 0 0 0 4 13 1 0 0 0 0 4 22 1 0 0 0 0 4 33 1 0 0 0 0 5 13 2 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 12 2 0 0 0 0 7 17 2 0 0 0 0 8 11 2 0 0 0 0 8 12 1 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 15 2 0 0 0 0 9 16 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 13 1 0 0 0 0 11 26 1 0 0 0 0 14 18 2 0 0 0 0 14 27 1 0 0 0 0 15 19 1 0 0 0 0 15 28 1 0 0 0 0 16 20 2 0 0 0 0 16 29 1 0 0 0 0 18 30 1 0 0 0 0 19 21 2 0 0 0 0 19 31 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 21 34 1 0 0 0 0 22 23 1 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 M END $$$$