BU2IY4 -OEChem-04022102542D 58 63 0 0 0 0 0 0 0999 V2000 6.3962 2.7510 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6523 -1.2559 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9042 1.7856 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3683 1.7856 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9042 2.7856 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6362 5.7857 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3846 5.8202 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.2888 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7586 1.2515 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7696 -5.7836 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6362 2.7856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6362 1.7856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5022 3.2856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5022 4.2857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7702 0.2856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7702 1.2856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6362 -0.2144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5022 1.2856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7702 3.2856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5022 0.2856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6362 4.7857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7702 4.2857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3962 4.8203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3022 3.2648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8602 -0.2212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7542 -1.7836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3022 4.3065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8522 -1.2628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1663 2.7615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7581 -2.7836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0343 3.2582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1625 1.7615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6260 -3.2803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 -3.2869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8984 2.7548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0266 1.2582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8945 1.7548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6299 -4.2802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8978 -4.2869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7658 -4.7836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0392 -0.0244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2332 4.5956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8380 4.6185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3140 -1.5707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3672 1.4756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9052 1.4756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3672 3.0956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0367 3.8782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6244 1.4536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0993 6.0956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1618 -2.9682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3559 -2.9790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4365 3.0628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0242 0.6382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1680 -4.5882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3621 -4.5990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2967 1.5594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2339 -6.0956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 24 1 0 0 0 0 2 17 1 0 0 0 0 2 26 1 0 0 0 0 3 16 1 0 0 0 0 3 45 1 0 0 0 0 4 18 1 0 0 0 0 4 46 1 0 0 0 0 5 19 1 0 0 0 0 5 47 1 0 0 0 0 6 21 1 0 0 0 0 6 50 1 0 0 0 0 7 23 2 0 0 0 0 8 25 2 0 0 0 0 9 37 1 0 0 0 0 9 57 1 0 0 0 0 10 40 1 0 0 0 0 10 58 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 19 2 0 0 0 0 12 16 2 0 0 0 0 12 18 1 0 0 0 0 13 14 2 0 0 0 0 14 21 1 0 0 0 0 14 23 1 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 15 25 1 0 0 0 0 17 20 1 0 0 0 0 18 20 2 0 0 0 0 19 22 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 22 42 1 0 0 0 0 23 27 1 0 0 0 0 24 27 2 0 0 0 0 24 29 1 0 0 0 0 25 28 1 0 0 0 0 26 28 2 0 0 0 0 26 30 1 0 0 0 0 27 43 1 0 0 0 0 28 44 1 0 0 0 0 29 31 2 0 0 0 0 29 32 1 0 0 0 0 30 33 2 0 0 0 0 30 34 1 0 0 0 0 31 35 1 0 0 0 0 31 48 1 0 0 0 0 32 36 2 0 0 0 0 32 49 1 0 0 0 0 33 38 1 0 0 0 0 33 51 1 0 0 0 0 34 39 2 0 0 0 0 34 52 1 0 0 0 0 35 37 2 0 0 0 0 35 53 1 0 0 0 0 36 37 1 0 0 0 0 36 54 1 0 0 0 0 38 40 2 0 0 0 0 38 55 1 0 0 0 0 39 40 1 0 0 0 0 39 56 1 0 0 0 0 M END $$$$