B8DPN1 -OEChem-04012119012D 47 49 0 1 0 0 0 0 0999 V2000 3.0000 0.0224 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 0.0224 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.0224 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9680 0.3230 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 1.0224 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 5.5032 1.9702 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8090 1.6101 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5000 2.5612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 2.5612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1910 1.6101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7601 1.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.9776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -1.4776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -1.4776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4543 1.6612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -2.4776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -2.4776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -2.9776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1974 2.3304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -3.9776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1485 2.0214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9895 3.3085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8916 2.6905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7326 3.9776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6837 3.6686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9060 0.9978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1064 2.6901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4352 3.1778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5648 3.1778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8936 2.6901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6246 1.8623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8810 1.0732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3743 2.5767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1632 1.1138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9428 1.2795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -1.1676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 -1.1676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -2.7877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 -2.7877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 -3.9776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -4.5976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -3.9776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2774 1.4149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3998 3.5001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4813 2.4989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6038 4.5841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1445 4.0835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 5 1 0 0 0 0 1 12 1 0 0 0 0 4 11 2 0 0 0 0 5 7 1 0 0 0 0 5 10 1 0 0 0 0 6 11 1 0 0 0 0 6 15 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 13 16 1 0 0 0 0 13 36 1 0 0 0 0 14 17 2 0 0 0 0 14 37 1 0 0 0 0 15 19 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 18 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 20 1 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 23 1 0 0 0 0 21 43 1 0 0 0 0 22 24 2 0 0 0 0 22 44 1 0 0 0 0 23 25 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 M END $$$$