D0N8RD -OEChem-10101305032D 47 49 0 1 0 0 0 0 0999 V2000 3.4030 -1.3870 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 1.6130 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 -0.5210 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 -2.2530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 0.1130 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.0094 1.9177 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -1.8870 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 0.1130 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.3312 0.6130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -0.8870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 0.6130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 0.1130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 1.6130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 0.6130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -1.3870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 1.6130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 2.1130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0094 0.3082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 0.6130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5930 1.1130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.1130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.6130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.8870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.8870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.1130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.3870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0021 -0.1970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6772 -1.4696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0757 -0.7794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9976 1.0879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2006 1.0879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -0.5070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 1.9230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2891 -0.8501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.6970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9091 -1.9240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -0.5070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 2.7330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2020 -0.2811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2020 2.5070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2130 1.1130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.2330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 -1.1970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.4230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.0070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.5770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -2.5070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 7 1 0 0 0 0 1 24 1 0 0 0 0 2 19 2 0 0 0 0 5 11 1 0 0 0 0 5 19 1 0 0 0 0 5 37 1 0 0 0 0 6 16 1 0 0 0 0 6 20 1 0 0 0 0 6 40 1 0 0 0 0 7 46 1 0 0 0 0 7 47 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 6 0 0 0 8 11 1 0 0 0 0 8 27 1 0 0 0 0 9 12 2 0 0 0 0 9 13 1 0 0 0 0 10 15 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 14 1 0 0 0 0 12 32 1 0 0 0 0 13 17 2 0 0 0 0 13 33 1 0 0 0 0 14 16 2 0 0 0 0 14 18 1 0 0 0 0 15 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 17 38 1 0 0 0 0 18 20 2 0 0 0 0 18 39 1 0 0 0 0 19 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 22 25 1 0 0 0 0 22 42 1 0 0 0 0 23 26 2 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 M END $$$$