BXW8A4 -OEChem-04012118262D 38 41 0 1 0 0 0 0 0999 V2000 5.9209 4.0165 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.2566 2.5279 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -1.3950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9422 -3.6529 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -0.5903 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.5903 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.0903 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.4097 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -2.3456 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4026 -3.1556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9405 -2.6529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -3.9636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.0903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.0903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 0.2144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 1.1649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.4097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.0903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 1.3712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3211 1.9092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2781 2.3217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6318 2.8598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6103 3.0660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4266 -1.9064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9411 -2.7415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9425 -3.5713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5572 -2.7167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0684 -2.0463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4553 -4.2745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2449 -4.5296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4445 -4.0165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3815 0.9097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.4003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7144 1.7814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 1.7197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.7197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2177 3.3212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6707 2.0664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 2 21 1 0 0 0 0 2 38 1 0 0 0 0 3 5 1 0 0 0 0 9 3 1 6 0 0 0 3 13 1 0 0 0 0 4 11 1 0 0 0 0 4 12 1 0 0 0 0 4 31 1 0 0 0 0 5 15 2 0 0 0 0 6 13 2 0 0 0 0 6 18 1 0 0 0 0 7 17 1 0 0 0 0 7 18 2 0 0 0 0 8 17 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 24 1 0 0 0 0 10 12 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 17 2 0 0 0 0 15 16 1 0 0 0 0 16 19 2 0 0 0 0 16 20 1 0 0 0 0 18 33 1 0 0 0 0 19 21 1 0 0 0 0 19 32 1 0 0 0 0 20 22 2 0 0 0 0 20 34 1 0 0 0 0 21 23 2 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 M END $$$$