B8JAU9 -OEChem-04012119302D 60 62 0 1 0 0 0 0 0999 V2000 8.5991 -1.1550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 0.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -1.6550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 -2.6550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 2.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 0.8450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.1550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 0.3450 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7331 -0.6550 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.4651 -0.6550 0.0000 C 0 0 3 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 8.5991 0.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 0.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8312 -0.2890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8312 -2.0210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 1.8450 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 -0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 -1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.6550 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 5.1350 -2.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 -1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 -0.1550 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 13.7953 -1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7953 -0.1550 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 7.7331 0.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -1.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0021 -0.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9976 1.3200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2006 1.3200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2565 0.9527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6550 0.2624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3681 -0.5990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1412 0.2480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2942 0.0210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2942 -1.7110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5212 -2.5580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3681 -2.3310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4040 2.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4040 -2.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.0350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -3.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7365 1.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5335 1.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 0.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6675 2.8200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8705 2.8200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3322 -1.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 0.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3322 0.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4662 -2.9650 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 1 9 1 0 0 0 0 1 10 1 0 0 0 0 2 10 1 0 0 0 0 2 12 1 0 0 0 0 3 11 1 0 0 0 0 3 20 1 0 0 0 0 4 25 1 0 0 0 0 4 59 1 0 0 0 0 5 31 1 0 0 0 0 5 60 1 0 0 0 0 6 31 2 0 0 0 0 7 19 1 0 0 0 0 7 24 2 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 8 13 1 0 0 0 0 8 32 1 0 0 0 0 9 14 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 15 1 0 0 0 0 11 16 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 17 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 18 1 0 0 0 0 14 19 2 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 42 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 45 1 0 0 0 0 18 22 2 0 0 0 0 18 46 1 0 0 0 0 19 47 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 48 1 0 0 0 0 22 24 1 0 0 0 0 22 49 1 0 0 0 0 23 27 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 52 1 0 0 0 0 25 28 2 0 0 0 0 26 29 1 0 0 0 0 26 53 1 0 0 0 0 27 31 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 28 30 1 0 0 0 0 28 56 1 0 0 0 0 29 30 2 0 0 0 0 29 57 1 0 0 0 0 30 58 1 0 0 0 0 M END $$$$