OTAVA-ZINC06143538 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 57 0 0 1 0 0 0 0 0999 V2000 -1.4130 1.4280 0.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1330 -0.0670 0.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6240 -0.5950 2.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3210 -1.9210 2.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5120 -2.6990 0.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2140 -4.0270 0.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 -4.6430 2.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4840 -3.8570 3.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 -2.4970 3.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1220 -4.8820 4.5250 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 -6.2720 3.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6410 -5.9320 2.2910 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 -7.5520 3.8000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4610 -8.7210 2.9160 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4410 -8.9200 2.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9790 -9.8860 3.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2730 -9.3740 5.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 -7.9210 5.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1010 -7.1770 5.9500 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7150 -10.0090 5.9420 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1320 -11.1890 3.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6770 -11.5600 2.0860 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7930 -12.1760 4.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1780 -13.4040 4.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8020 -14.3220 5.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0350 -14.0320 5.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6510 -12.8190 5.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0410 -11.8920 4.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3510 -8.4840 1.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9650 -8.9320 0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7820 -8.7150 -0.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9850 -8.0500 -0.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3700 -7.6020 0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5500 -7.8140 1.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0100 -7.7770 -1.8380 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 1.9440 1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8010 1.8320 0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1470 1.5750 1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0570 -0.5820 0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3980 -0.2130 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9000 -2.2440 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3680 -4.6150 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 -1.8940 4.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8300 -12.4920 1.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -13.6320 4.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3280 -15.2710 5.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5200 -14.7550 6.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6120 -12.5990 5.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5240 -10.9480 4.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 -9.4520 0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4800 -9.0650 -1.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3090 -7.0820 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8490 -7.4610 2.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 39 1 0 0 0 0 2 40 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 41 1 0 0 0 0 6 7 1 0 0 0 0 6 42 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 10 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 29 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 1 0 0 0 0 17 20 2 0 0 0 0 18 19 2 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 50 1 0 0 0 0 31 32 1 0 0 0 0 31 51 1 0 0 0 0 32 33 2 0 0 0 0 32 35 1 0 0 0 0 33 34 1 0 0 0 0 33 52 1 0 0 0 0 34 53 1 0 0 0 0 M END