OTAVA-ZINC04539532 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -0.7500 2.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6990 -1.2080 3.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0640 -1.4200 3.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7660 -1.1750 2.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0940 -0.7200 1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1080 -1.3830 2.2530 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -1.8560 3.4480 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2360 -2.7680 3.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2060 -2.1520 3.1680 C 0 0 3 0 0 0 0 0 0 0 0 0 6.6660 -2.5800 4.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9320 -0.8550 2.7910 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5140 -0.4560 1.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7330 0.1560 3.9210 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1660 -0.2380 4.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2290 0.3810 4.1190 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7920 0.7490 3.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6200 -0.8580 4.4690 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0360 1.4240 5.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7590 2.6050 4.8540 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1540 2.3960 4.6250 C 0 0 3 0 0 0 0 0 0 0 0 0 7.6250 2.0580 5.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3430 1.4070 3.6060 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7880 3.6900 4.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7460 4.7960 5.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3280 5.9840 4.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9510 6.0650 3.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9940 4.9590 2.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4160 3.7700 2.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3250 -1.1170 2.6150 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3100 -3.1060 2.0610 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2220 -4.4300 2.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0580 -4.8310 3.4340 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3290 -5.4110 1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0330 -0.5830 2.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1520 -1.3990 4.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5830 -1.7780 4.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6380 -0.5320 0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9770 1.6580 5.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4200 1.0360 6.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2590 4.7330 5.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2940 6.8480 5.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4050 6.9930 3.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4810 5.0220 1.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4520 2.9050 2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5190 -1.7620 1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4410 -2.7860 1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3720 -5.6910 1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7420 -6.3000 1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9480 -4.9520 0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 40 1 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 43 1 0 0 0 0 6 7 2 0 0 0 0 6 44 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 45 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 20 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 33 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 32 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 25 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 30 2 0 0 0 0 29 50 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 32 53 1 0 0 0 0 33 34 1 0 0 0 0 33 54 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 36 55 1 0 0 0 0 36 56 1 0 0 0 0 36 57 1 0 0 0 0 M END