B8VAZ2 -OEChem-04022100392D 35 36 0 0 0 0 0 0 0999 V2000 5.4543 -2.2694 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 2.6785 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4863 1.0312 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4543 -2.2694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4543 -2.2694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2633 2.3184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9543 3.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4543 1.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9543 3.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6453 2.3184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4543 0.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3203 0.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5883 0.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6942 2.0094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4543 -1.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3203 -0.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5883 -0.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4543 -3.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.3695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5733 1.7814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8297 2.5705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5607 3.3983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8895 3.8860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0191 3.8860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3478 3.3983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8572 0.5406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0513 0.5406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8572 -1.0794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0513 -1.0794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8343 -3.2694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4543 -3.8894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0743 -3.2694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8084 2.9591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4103 2.1779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1916 1.7798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 15 1 0 0 0 0 1 18 1 0 0 0 0 2 14 1 0 0 0 0 2 19 1 0 0 0 0 3 14 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 20 1 0 0 0 0 6 21 1 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 7 23 1 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 12 16 1 0 0 0 0 12 26 1 0 0 0 0 13 17 2 0 0 0 0 13 27 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 16 28 1 0 0 0 0 17 29 1 0 0 0 0 18 30 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 M END $$$$