D0P2TS -OEChem-10101305032D 47 48 0 1 0 0 0 0 0999 V2000 5.4071 1.7063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.1185 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.1185 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5158 3.3618 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7891 1.7063 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.3815 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 2.6573 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9170 4.3799 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.8815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.3815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.3815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.8815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.3815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.3815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.8815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.3815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.3815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.1185 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4641 -0.3815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.1185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.1185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0981 2.6573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5103 3.4664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -2.5715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -2.7989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 -3.4892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 -3.4892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 -2.7989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -1.2989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -1.9892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 -4.2738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -4.9641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 -4.9641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 -4.2738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4675 -5.3564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2646 -5.3564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 -1.9641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 -1.2738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 0.2011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 -0.4892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.5015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0656 -0.8564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8626 -0.8564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.0015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -0.1915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5526 4.8815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5336 4.4447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 20 1 0 0 0 0 2 21 2 0 0 0 0 3 6 1 0 0 0 0 3 45 1 0 0 0 0 4 23 2 0 0 0 0 5 20 2 0 0 0 0 5 22 1 0 0 0 0 6 21 1 0 0 0 0 6 44 1 0 0 0 0 7 22 2 0 0 0 0 8 23 1 0 0 0 0 8 46 1 0 0 0 0 8 47 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 9 24 1 0 0 0 0 10 13 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 11 14 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 16 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 15 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 18 17 1 1 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 41 1 0 0 0 0 19 21 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 22 23 1 0 0 0 0 M END $$$$