B3BPG6 -OEChem-04012114292D 41 44 0 1 0 0 0 0 0999 V2000 3.3080 0.1149 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4350 -2.0263 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6227 0.7785 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6227 -3.2215 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9771 -0.6283 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8080 0.9809 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7861 0.7730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8907 -0.2215 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 3.4013 1.8944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6227 -0.2215 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 5.7567 -1.7215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4888 -1.7215 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 3.9890 2.7035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4067 1.9990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4350 -0.4168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0186 -1.2215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 3.6170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.9125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 3.7215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4888 1.2785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7567 -3.7215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1888 1.0134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4061 0.7730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8510 1.3896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2198 -2.0315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6056 2.6386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0423 1.4974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6276 0.1725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6386 -1.2215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9467 4.1186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 2.9773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3356 4.2879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7988 0.7415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0257 1.5885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1788 1.8154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4467 -3.1846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2198 -4.0315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0667 -4.2585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 6 1 0 0 0 0 2 14 1 0 0 0 0 2 19 1 0 0 0 0 3 11 1 0 0 0 0 3 23 1 0 0 0 0 4 15 1 0 0 0 0 4 24 1 0 0 0 0 5 8 2 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 9 11 1 0 0 0 0 9 13 2 0 0 0 0 10 16 2 0 0 0 0 10 17 1 0 0 0 0 11 12 2 0 0 0 0 12 14 1 0 0 0 0 12 18 1 0 0 0 0 13 15 1 0 0 0 0 13 28 1 0 0 0 0 14 15 2 0 0 0 0 16 20 1 0 0 0 0 16 29 1 0 0 0 0 17 21 2 0 0 0 0 17 30 1 0 0 0 0 18 19 2 0 0 0 0 18 31 1 0 0 0 0 19 32 1 0 0 0 0 20 22 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 35 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 M END $$$$