D0HM5J -OEChem-08022023152D 55 58 0 1 0 0 0 0 0999 V2000 4.2782 1.9085 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0695 -0.5887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8100 -2.3934 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3936 -1.5887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4217 0.6427 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9356 0.9113 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.8100 -0.7840 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8016 -1.5887 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2035 0.9113 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3773 0.3480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5564 2.4396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0564 1.5736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5452 2.5887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0695 0.4113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8016 0.4113 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.6676 0.9113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5336 0.4113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2657 -0.5887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1317 -1.0887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8638 -1.0887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5336 -0.5887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3997 0.9113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3997 -1.0887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2657 0.4113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9977 -0.5887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8638 -2.0887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1317 -2.0887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9977 -2.5887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8016 -0.5887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3936 -1.5887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1207 0.1666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7517 1.2010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0673 -0.1889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8318 -0.0737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6027 3.0579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9639 2.6224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6019 1.9953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5441 1.2244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0575 2.9380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3187 3.1658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.1883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8016 1.0313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0662 1.3863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2691 1.3863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9356 1.5313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9967 -0.8987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3997 1.5313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3997 -1.7087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8026 0.7213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9977 0.0313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5948 -2.3987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9977 -3.2087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7100 -0.0260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3133 0.7559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5313 0.3592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 13 1 0 0 0 0 2 14 2 0 0 0 0 3 26 1 0 0 0 0 3 30 1 0 0 0 0 4 30 2 0 0 0 0 5 10 1 0 0 0 0 5 12 1 0 0 0 0 5 41 1 0 0 0 0 6 14 1 0 0 0 0 15 6 1 1 0 0 0 6 45 1 0 0 0 0 7 20 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 29 3 0 0 0 0 9 10 1 0 0 0 0 9 14 1 6 0 0 0 9 32 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 21 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 18 24 1 0 0 0 0 19 25 2 0 0 0 0 19 27 1 0 0 0 0 20 25 1 0 0 0 0 20 26 2 0 0 0 0 21 23 1 0 0 0 0 21 46 1 0 0 0 0 22 24 2 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 24 49 1 0 0 0 0 25 50 1 0 0 0 0 26 28 1 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 M END $$$$