D06FLU Wcorina 10100417203D 1 1.00000 0.00000 CORINA evaluation license 3.40 0067 02.08.2006 45 48 0 1 0 0 0 0 0999 V2000 0.0135 -3.0209 -2.8389 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.9748 -0.9412 6.4269 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.0164 1.3553 0.0095 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0129 -0.0206 -2.3808 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6687 3.3106 3.8645 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 1.9556 6.1377 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6131 -4.1896 2.3045 N 0 0 3 0 0 0 0 0 0 0 0 0 0.0414 -2.8507 2.5085 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0331 -2.1105 1.1965 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8755 -2.1078 3.5492 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0172 -2.7921 -0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1514 -4.9329 1.3009 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0231 -0.7139 1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0087 -4.2927 -0.0698 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4481 -0.6682 3.6449 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 0.0103 2.4949 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0021 -0.0041 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0096 -2.0824 -1.1973 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 -4.9316 3.5705 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0003 -0.6988 -1.2018 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4533 -0.0166 4.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3226 1.3496 2.5665 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3083 2.0015 3.7878 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0756 1.3165 4.9373 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2479 2.0213 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0507 3.9507 2.6453 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9804 -2.9465 2.8756 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7468 -2.5858 4.5203 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9268 -2.1519 3.2647 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2155 -5.9584 1.2577 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2036 -4.9409 1.5852 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8472 -4.6030 -0.6933 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9171 -4.6411 -0.5275 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3223 -5.0391 3.9828 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1077 -5.9184 3.3909 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3079 -4.3878 4.2772 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6205 1.8782 1.6731 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8669 0.1821 -2.7273 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0905 3.0999 0.0083 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8173 1.7313 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8003 1.7409 -0.8958 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9195 2.3855 6.3514 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2195 3.9166 1.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9105 3.4348 2.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3135 4.9892 2.8471 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 2 21 1 0 0 0 0 3 17 1 0 0 0 0 3 25 1 0 0 0 0 4 20 1 0 0 0 0 4 38 1 0 0 0 0 5 23 1 0 0 0 0 5 26 1 0 0 0 0 6 24 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 7 19 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 27 1 0 0 0 0 9 11 2 0 0 0 0 9 13 1 0 0 0 0 10 15 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 14 1 0 0 0 0 11 18 1 0 0 0 0 12 14 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 16 1 0 0 0 0 13 17 2 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 21 2 0 0 0 0 16 22 2 0 0 0 0 17 20 1 0 0 0 0 18 20 2 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 24 2 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 M END $$$$