NIH-ZINC04019699 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 -1.1610 0.7400 0.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2260 1.1110 0.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 2.9510 0.8910 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3870 3.1890 -0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5150 3.3090 1.6380 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2400 2.5200 1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1170 4.6110 1.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5630 4.7130 1.6090 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1500 3.9070 1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1540 6.0550 1.1820 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2480 6.0800 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5120 6.2420 1.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5180 6.8810 1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7620 7.0610 1.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0040 6.6060 2.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0050 5.9580 3.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7490 5.7680 3.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6800 5.0550 3.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5940 4.5900 3.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5550 3.9900 3.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6380 3.9390 5.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3440 3.3830 3.1420 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1400 4.2270 3.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 3.8560 2.8710 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9580 3.6810 1.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7490 4.1500 0.6140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6890 2.5620 3.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 2.0720 4.4150 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7620 1.9480 2.9210 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2350 5.1650 4.2500 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 2.0640 3.6500 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7570 4.8760 5.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2400 5.5120 4.9510 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2290 7.4600 -0.4980 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.2900 7.1110 1.6070 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.3250 0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 1.0340 -0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0360 0.9400 1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 1.3740 -0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 0.0350 0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0690 1.6320 0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5420 5.4570 1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1020 4.6090 0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5460 7.5620 1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9750 6.7560 3.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2130 2.3390 2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0840 1.1150 3.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9160 4.6490 3.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 2.0260 4.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7320 5.6980 5.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5800 4.6070 4.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6020 7.9940 1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 1.5070 1.0220 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 2 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 31 1 0 0 0 0 23 24 1 0 0 0 0 23 30 2 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 24 48 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 31 49 1 0 0 0 0 32 50 1 0 0 0 0 33 51 1 0 0 0 0 35 52 1 0 0 0 0 M END