B9OEN2 -OEChem-04022107002D 39 40 0 1 0 0 0 0 0999 V2000 6.4021 -3.1217 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5411 -0.6571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6443 -2.4172 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2112 -2.5339 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5931 -3.7094 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.9307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.9307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.9307 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.4307 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 -1.6082 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2320 -1.6082 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9230 -0.6571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.0693 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8198 -2.4172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8144 -2.3126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.4307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.4307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.4307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9899 -3.9307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.9307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.9307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8444 -1.5112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5135 -2.1606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6130 -0.1202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3566 -0.9093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2845 0.2122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2626 -2.6890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9907 -3.0132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3716 -2.0409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6435 -1.7167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0277 -2.3524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 1.1207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4883 -4.2951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3544 -4.4323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4915 -3.5663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.7407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 3.4676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 3.2407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 2.3938 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 19 1 0 0 0 0 2 10 1 0 0 0 0 2 13 1 0 0 0 0 11 3 1 1 0 0 0 3 31 1 0 0 0 0 6 17 2 0 0 0 0 7 20 2 0 0 0 0 13 8 1 6 0 0 0 8 16 1 0 0 0 0 8 17 1 0 0 0 0 9 17 1 0 0 0 0 9 20 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 6 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 12 25 1 0 0 0 0 13 26 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 16 18 2 0 0 0 0 16 32 1 0 0 0 0 18 20 1 0 0 0 0 18 21 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 21 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 M END $$$$