B4DRW6 -OEChem-04012114102D 46 48 0 0 0 0 0 0 0999 V2000 6.7210 2.7653 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.0101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.0101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.5101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4939 0.1440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9939 -2.4540 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4939 -3.3201 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4103 0.2053 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9939 -0.7220 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9939 1.0101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.5101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.5101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4103 1.8148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9939 1.0101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.0101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.0101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7210 -0.7452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.5101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.5101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4939 0.1440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4939 1.8761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4939 0.1440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4939 1.8761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9939 1.0101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.0101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9939 -0.7220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4939 -1.5880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4939 -1.5880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9939 -2.4540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.6099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.6301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1317 -0.9378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9136 -1.3345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3103 -0.5526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1839 -0.3929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1839 2.4130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8039 2.4130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6139 1.0101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6839 -1.2589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9113 -1.8001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6016 -2.1986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.6099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0765 -1.3760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3863 -0.9774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 3.3201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3039 -2.9910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 2 19 1 0 0 0 0 2 42 1 0 0 0 0 3 25 1 0 0 0 0 3 45 1 0 0 0 0 4 25 2 0 0 0 0 5 26 2 0 0 0 0 6 29 1 0 0 0 0 6 46 1 0 0 0 0 7 29 2 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 8 17 1 0 0 0 0 9 22 1 0 0 0 0 9 26 1 0 0 0 0 9 39 1 0 0 0 0 10 13 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 15 2 0 0 0 0 12 13 1 0 0 0 0 12 16 2 0 0 0 0 14 20 2 0 0 0 0 14 21 1 0 0 0 0 15 19 1 0 0 0 0 15 30 1 0 0 0 0 16 18 1 0 0 0 0 16 31 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 19 2 0 0 0 0 18 25 1 0 0 0 0 20 22 1 0 0 0 0 20 35 1 0 0 0 0 21 23 2 0 0 0 0 21 36 1 0 0 0 0 22 24 2 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 24 38 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 40 1 0 0 0 0 27 41 1 0 0 0 0 28 29 1 0 0 0 0 28 43 1 0 0 0 0 28 44 1 0 0 0 0 M END $$$$