ASINEX-ZINC05001918 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5220 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -0.0080 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3520 -0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 -0.5150 1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 -0.6690 1.3280 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 -0.4780 0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3070 -1.1620 2.6210 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 -1.2750 3.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 -0.8740 2.3470 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -1.7600 4.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9680 -2.1480 5.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7050 -2.5930 6.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4690 -2.6540 7.1380 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 -2.2960 6.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3930 -1.8340 5.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 -0.5170 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0520 -0.6410 -1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5260 -0.3310 -2.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3150 -1.1090 -1.1350 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0560 -1.1480 -2.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4250 -1.4250 -3.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1580 -1.4630 -4.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5210 -1.2240 -4.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1520 -0.9470 -3.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4250 -0.9140 -2.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5220 -1.2770 -6.2720 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 1.9010 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 1.8880 -0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8660 0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9820 -2.1020 5.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5230 -2.8960 7.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5620 -2.3620 6.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -1.5390 4.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7900 -0.7640 0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7110 -1.4200 -0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3610 -1.6110 -3.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6680 -1.6780 -5.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2160 -0.7610 -3.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9190 -0.7020 -1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 16 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 36 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 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 38 1 0 0 0 0 25 39 1 0 0 0 0 M END