D0CR6M Wcorina 10100417213D 1 1.00000 0.00000 CORINA evaluation license 3.40 0067 02.08.2006 30 31 0 0 0 0 0 0 0999 V2000 -7.8802 -0.3181 0.0747 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.0162 1.3438 0.0094 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6105 1.1668 0.0329 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0629 -0.5975 -0.0113 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3858 -2.8543 0.0095 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6372 -2.2769 0.0246 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7724 -0.8784 0.0334 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2554 -2.1365 0.0026 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2606 -0.7562 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5521 -0.0503 0.0262 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7818 -3.0705 0.0307 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0397 -0.2958 0.0481 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0666 -2.8598 -0.0135 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 -6.0271 -2.4825 0.0454 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1586 -1.1001 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2684 2.0206 0.0008 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0474 3.5345 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3211 -3.8221 0.0079 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6927 -4.1468 0.0237 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1433 0.7792 0.0553 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1079 -3.9358 -0.0173 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6236 -2.5789 -0.9073 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6403 -2.5880 0.8725 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9109 -3.1032 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8378 1.7305 0.8838 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8208 1.7401 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 3.8245 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4950 3.8150 0.9079 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0118 4.0425 0.0046 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 2 14 1 0 0 0 0 2 17 1 0 0 0 0 3 10 2 0 0 0 0 4 14 2 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 19 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 10 1 0 0 0 0 7 12 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 11 15 2 0 0 0 0 11 20 1 0 0 0 0 12 16 2 0 0 0 0 12 21 1 0 0 0 0 13 22 1 0 0 0 0 13 23 1 0 0 0 0 13 24 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 17 18 1 0 0 0 0 17 26 1 0 0 0 0 17 27 1 0 0 0 0 18 28 1 0 0 0 0 18 29 1 0 0 0 0 18 30 1 0 0 0 0 M END $$$$