NIH-ZINC02972582 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 63 0 0 1 0 0 0 0 0999 V2000 1.2670 1.8530 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6950 0.6320 -0.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2460 -0.5690 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3630 -0.4580 1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 0.7110 1.6110 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3970 1.8410 1.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6860 -1.9340 -0.4760 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9260 -2.6650 -0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7630 -2.0390 -2.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6560 -3.3880 -2.5910 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4960 -4.4270 -2.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3730 -4.2940 -1.3940 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3170 -5.7160 -2.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0550 -6.1440 -3.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9210 -7.3680 -4.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 -8.1320 -4.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2840 -7.7240 -3.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4490 -6.5250 -3.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2650 -8.6250 -4.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5160 -9.6450 -4.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1100 -9.3410 -4.8810 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8170 -2.9630 1.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1010 -3.6550 2.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2640 -2.7740 1.9100 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4580 -2.1900 0.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1810 -1.4780 0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1610 -2.5580 2.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7930 -1.3150 3.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7010 -1.0970 4.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9920 -2.1280 5.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3920 -3.3690 4.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4830 -3.5770 3.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8610 -1.9230 6.0460 F 0 0 0 0 0 0 0 0 0 0 0 0 1.6070 2.7910 -0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3830 0.6420 -1.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -1.3350 1.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 2.7660 1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9310 -1.4800 -2.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6900 -1.6040 -2.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9470 -3.5340 -3.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 -5.5540 -3.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -7.7130 -4.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4290 -6.2240 -2.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9300 -9.7580 -5.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6300 -10.5930 -4.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9860 -3.6740 1.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5640 -2.1100 2.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9370 -3.9360 3.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2710 -4.5790 1.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2970 -1.4880 0.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7040 -2.9990 -0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9530 -0.6250 0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2950 -1.1440 -0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5660 -0.4770 2.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1730 -0.1290 4.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6370 -4.1700 5.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0510 -4.5690 3.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9950 -2.4310 0.1640 N 0 3 0 0 0 0 0 0 0 0 0 0 3.2730 -3.2680 -0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 58 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 40 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 2 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 58 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 26 58 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 30 31 2 0 0 0 0 30 33 1 0 0 0 0 31 32 1 0 0 0 0 31 56 1 0 0 0 0 32 57 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END