BBPZ30 -OEChem-04012118012D 37 39 0 0 0 0 0 0 0999 V2000 7.4888 3.7215 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.9771 -0.3717 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.4888 3.7215 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4887 3.7215 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8907 1.2215 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7567 -0.2785 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7861 -1.7730 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 -3.7035 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4888 2.7215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6227 1.2215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6227 2.2215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3548 2.2215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4888 0.7215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3548 1.2215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4888 4.7215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7567 0.7215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8907 -0.7785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8080 -1.9809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 -2.8944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3080 -1.1149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4067 -2.9990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.9125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 -4.7215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 -4.6170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0858 2.5315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8917 2.5315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4888 0.1015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8917 0.9115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1088 4.7215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4888 5.3415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8688 4.7215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2936 -0.5885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6914 -1.0501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0423 -2.4974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 -3.9773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3356 -5.2879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9467 -5.1186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 9 1 0 0 0 0 1 15 1 0 0 0 0 2 17 1 0 0 0 0 2 20 1 0 0 0 0 5 16 2 0 0 0 0 6 16 1 0 0 0 0 6 17 1 0 0 0 0 6 32 1 0 0 0 0 7 17 2 0 0 0 0 7 18 1 0 0 0 0 8 19 1 0 0 0 0 8 24 2 0 0 0 0 9 11 1 0 0 0 0 9 12 2 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 10 16 1 0 0 0 0 11 25 1 0 0 0 0 12 14 1 0 0 0 0 12 26 1 0 0 0 0 13 14 2 0 0 0 0 13 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 15 31 1 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 19 21 2 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 22 23 2 0 0 0 0 22 35 1 0 0 0 0 23 24 1 0 0 0 0 23 36 1 0 0 0 0 24 37 1 0 0 0 0 M END $$$$