OTAVA-ZINC04539451 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 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 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -1.8490 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3890 -2.6800 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 -4.0520 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8230 -4.6000 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9340 -3.7770 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7760 -2.4000 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8680 -1.5890 0.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1480 -2.2250 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9960 -6.0970 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0390 -6.5900 1.3670 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2130 -6.7180 2.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5370 -6.4390 1.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5420 -6.6520 2.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2440 -7.1450 3.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9310 -7.4240 4.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9260 -7.2120 3.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4310 -7.4060 3.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 -6.9760 2.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 -6.9760 1.6620 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 -6.5840 4.4380 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5660 -6.7110 4.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9140 -8.1800 4.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 -9.0440 3.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1130 -8.7770 3.6480 O 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -2.2550 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 -4.6980 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9240 -4.2070 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9300 -1.4660 0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2570 -2.8410 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2320 -2.8520 0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9270 -6.3520 -0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1590 -6.5570 -0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7780 -6.0530 0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5660 -6.4340 2.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0340 -7.3100 4.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6950 -7.8090 5.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 -6.3860 3.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9240 -6.0970 5.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9970 -8.3060 4.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 -8.4820 5.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7510 -8.8000 2.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -10.0980 3.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 20 27 1 0 0 0 0 21 22 2 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 M END