BG3A1E -OEChem-04022106412D 58 62 0 1 0 0 0 0 0999 V2000 9.2174 0.6708 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3457 0.0723 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -0.5208 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 9.0421 -0.9377 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 0.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4920 -1.0347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4920 1.0347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 -1.0241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -0.5275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2385 0.4666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7141 -0.1972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7082 -0.3055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2991 0.5012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2932 0.3928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6964 -0.5223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1114 -1.2206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1055 -1.3290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8957 1.2426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7301 -0.6511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3520 0.1845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9320 1.1377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9397 0.8767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0089 0.4147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6071 1.1045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0874 -1.5044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8856 -1.5137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8856 1.5137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0874 1.5044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8618 -1.4976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6589 -1.5006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7793 0.8833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0491 1.0686 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7451 -1.7208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3555 -1.8964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -2.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 -2.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 2.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 2.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6391 1.8070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9735 -1.2213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2964 1.6393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4385 0.5085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3080 1.3755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4409 1.2450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 16 1 0 0 0 0 2 26 1 0 0 0 0 3 17 1 0 0 0 0 3 27 1 0 0 0 0 4 30 1 0 0 0 0 4 32 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 5 12 1 0 0 0 0 6 15 1 0 0 0 0 6 19 2 0 0 0 0 7 9 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 10 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 11 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 11 14 2 0 0 0 0 12 15 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 16 1 0 0 0 0 13 41 1 0 0 0 0 14 17 1 0 0 0 0 14 42 1 0 0 0 0 15 18 2 0 0 0 0 16 17 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 28 1 0 0 0 0 23 25 1 0 0 0 0 23 29 1 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 28 31 2 0 0 0 0 28 53 1 0 0 0 0 29 30 2 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 31 55 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 M END $$$$