NIH-ZINC04019699 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 -2.5470 1.1200 1.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2780 1.2060 0.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 3.1950 1.3980 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8250 3.4790 0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0770 3.7090 2.5960 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9880 3.1160 2.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4930 5.1650 2.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5360 5.5320 3.4460 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.4480 4.9610 3.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8480 7.0240 3.3500 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.3340 7.2300 2.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7570 7.4440 4.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7300 8.3990 4.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5580 8.7970 5.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4170 8.2460 6.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4480 7.2820 6.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6170 6.8700 5.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6100 5.8120 5.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0060 5.2060 4.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0040 4.3430 5.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5790 4.1450 6.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3270 3.5820 3.9020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1030 4.0150 3.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7690 4.1010 2.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 3.7640 1.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6370 3.9760 0.3070 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 4.5160 2.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4740 5.6590 2.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1490 3.6290 2.8800 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 4.3320 4.9250 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 2.2020 4.2690 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2940 5.4750 7.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3050 6.7400 8.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9180 9.1040 2.6830 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.6300 7.7670 3.4300 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4510 0.0340 1.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9850 1.4400 0.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1910 1.4330 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 1.5270 -0.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2710 0.1170 0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 1.5840 0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6230 5.8130 2.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9240 5.2840 1.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3180 9.5430 5.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0620 8.5670 7.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9220 2.7000 3.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0740 3.9190 2.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6580 4.6780 4.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9210 2.0260 5.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7080 3.2620 6.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8430 5.9500 8.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7500 8.7250 3.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 1.7300 1.4700 N 0 0 0 0 0 0 0 0 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 1 53 1 0 0 0 0 2 39 1 0 0 0 0 2 40 1 0 0 0 0 2 41 1 0 0 0 0 2 53 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 25 1 0 0 0 0 3 53 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 22 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 19 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 35 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 15 16 2 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 32 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 31 1 0 0 0 0 23 24 2 0 0 0 0 23 30 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 25 26 2 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 30 48 1 0 0 0 0 31 49 1 0 0 0 0 33 51 1 0 0 0 0 35 52 1 0 0 0 0 M END