B8PD3N -OEChem-04012114242D 43 43 0 1 0 0 0 0 0999 V2000 7.7331 -2.6550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.6550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 0.8450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.6550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -0.6550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 3.3450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 2.3450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -1.1550 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.4651 -0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -2.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 0.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -3.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1316 -0.1801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3346 -0.1801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2006 -1.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9976 -1.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8637 -0.1801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0666 -0.1801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9326 -1.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7297 -1.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7341 -0.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -0.0350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 2.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1131 -3.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -4.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3531 -3.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8059 3.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.0350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 2.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 21 1 0 0 0 0 2 13 2 0 0 0 0 3 14 2 0 0 0 0 10 4 1 1 0 0 0 4 14 1 0 0 0 0 4 29 1 0 0 0 0 5 12 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 18 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 7 19 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 22 1 0 0 0 0 8 23 1 0 0 0 0 9 11 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 10 13 1 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 16 18 1 0 0 0 0 16 34 1 0 0 0 0 17 20 2 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 M END $$$$