BQ1YS3 -OEChem-04012120322D 59 62 0 1 0 0 0 0 0999 V2000 8.9701 0.3104 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 7.1884 3.3692 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.6992 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.3608 0.6683 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.3674 -1.0599 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.1884 1.3208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4506 4.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3166 2.8450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3166 1.8450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1826 -4.6550 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 12.4506 -4.6550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5846 1.8450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.3166 -4.1550 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 11.5846 2.8450 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.7185 3.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7185 1.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8525 2.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8525 1.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9586 1.3103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9586 3.3797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4506 3.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4506 1.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0525 1.8242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0525 2.8658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4506 0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3205 1.8175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3166 -0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4564 1.3142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3166 -1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4602 0.3142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5884 1.8108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7282 0.3075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5961 -0.1892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7243 1.3075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1826 -1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4506 -1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1826 -2.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4506 -2.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 -0.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3166 -3.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1215 2.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1171 3.8200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3200 3.8200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3200 0.8701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1171 0.8701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9657 3.9996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9136 0.0350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9875 4.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7172 2.2940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9201 2.2909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8535 0.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9984 0.0063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5860 2.4308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5985 -0.8091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1862 1.6154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7196 -1.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9136 -1.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7196 -2.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9136 -2.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 2 24 1 0 0 0 0 3 39 1 0 0 0 0 4 39 1 0 0 0 0 5 39 1 0 0 0 0 6 23 1 0 0 0 0 6 26 1 0 0 0 0 7 21 1 0 0 0 0 7 48 1 0 0 0 0 8 21 2 0 0 0 0 9 22 2 0 0 0 0 10 13 1 0 0 0 0 11 13 2 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 12 22 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 21 1 1 0 0 0 14 41 1 0 0 0 0 15 17 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 18 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 20 2 0 0 0 0 18 19 2 0 0 0 0 19 23 1 0 0 0 0 20 24 1 0 0 0 0 20 46 1 0 0 0 0 22 25 1 0 0 0 0 23 24 2 0 0 0 0 25 27 2 0 0 0 0 25 47 1 0 0 0 0 26 28 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 29 1 0 0 0 0 27 51 1 0 0 0 0 28 30 2 0 0 0 0 28 31 1 0 0 0 0 29 35 2 0 0 0 0 29 36 1 0 0 0 0 30 33 1 0 0 0 0 30 52 1 0 0 0 0 31 34 2 0 0 0 0 31 53 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 32 39 1 0 0 0 0 33 54 1 0 0 0 0 34 55 1 0 0 0 0 35 37 1 0 0 0 0 35 56 1 0 0 0 0 36 38 2 0 0 0 0 36 57 1 0 0 0 0 37 40 2 0 0 0 0 37 58 1 0 0 0 0 38 40 1 0 0 0 0 38 59 1 0 0 0 0 M CHG 2 10 -1 13 1 M END $$$$