BO61RK -OEChem-04012114512D 44 45 0 1 0 0 0 0 0999 V2000 5.4641 -0.1550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5981 1.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.8450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8600 0.8450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5870 2.6002 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8600 0.8450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.3450 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5981 0.3450 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4641 1.8450 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7320 -0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0981 2.2110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2764 1.6497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2764 0.0403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5870 -0.9103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3600 -0.0210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 0.4276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 -0.2627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6350 2.5210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7881 2.7480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5611 1.9010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 -1.7376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 -1.0473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2881 1.8819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -1.0724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -1.7627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 3.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0781 -3.2376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4766 -2.5473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1730 -1.3717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1937 -1.0381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -2.6181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -3.6919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8230 -0.3310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6700 -0.5580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8969 0.2890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 13 1 0 0 0 0 7 2 1 6 0 0 0 2 31 1 0 0 0 0 9 3 1 1 0 0 0 3 34 1 0 0 0 0 4 6 1 0 0 0 0 4 21 1 0 0 0 0 5 15 2 0 0 0 0 6 15 1 0 0 0 0 6 16 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 8 10 1 1 0 0 0 8 22 1 0 0 0 0 9 11 1 0 0 0 0 9 23 1 0 0 0 0 10 14 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 13 2 0 0 0 0 11 15 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 16 1 0 0 0 0 14 17 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 16 19 2 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 20 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 M END $$$$