B8RXS7 -OEChem-04022109432D 40 42 0 1 0 0 0 0 0999 V2000 5.8981 4.2867 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.9470 3.5958 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 0.2479 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -0.7521 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 1.7479 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -0.7521 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1092 1.7177 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -4.2521 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9292 -0.2176 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2071 2.3357 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8981 3.2868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8981 3.2868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5891 2.3357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 0.7479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 0.2479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1582 2.0267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -1.2521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -2.2521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -2.7521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -3.7521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -2.7521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -2.2174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -4.2867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -3.7521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.7313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.7729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9176 -1.2175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3041 1.7233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5045 3.4157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8333 3.9034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0227 2.5879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2791 1.7988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3200 0.8305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9215 0.1402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 -1.0621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 -2.4421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -4.9067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -2.4192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 -4.0621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -4.0850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 2 12 1 0 0 0 0 3 14 2 0 0 0 0 4 17 2 0 0 0 0 5 10 1 0 0 0 0 5 13 1 0 0 0 0 5 14 1 0 0 0 0 6 15 1 0 0 0 0 6 17 1 0 0 0 0 6 35 1 0 0 0 0 7 16 3 0 0 0 0 8 20 1 0 0 0 0 8 24 2 0 0 0 0 9 27 3 0 0 0 0 10 11 1 0 0 0 0 10 16 1 1 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 21 2 0 0 0 0 19 20 1 0 0 0 0 19 22 2 0 0 0 0 20 23 2 0 0 0 0 21 24 1 0 0 0 0 21 36 1 0 0 0 0 22 25 1 0 0 0 0 22 27 1 0 0 0 0 23 26 1 0 0 0 0 23 37 1 0 0 0 0 24 39 1 0 0 0 0 25 26 2 0 0 0 0 25 38 1 0 0 0 0 26 40 1 0 0 0 0 M END $$$$