NIH-ZINC04111942 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 63 0 0 0 0 0 0 0 0999 V2000 0.4320 1.5800 1.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3150 0.1380 1.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9510 -0.8480 2.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -2.1710 1.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 -2.5100 0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 -1.5180 -0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4320 -0.1970 0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -3.8470 0.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5830 -4.8340 1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0840 -4.8250 0.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6200 -4.0690 0.2070 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8310 -5.6580 1.7410 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2160 -5.7180 1.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7540 -5.5360 0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1260 -5.5950 0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9620 -5.8350 1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4260 -6.0170 2.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0530 -5.9640 2.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2460 -6.2530 3.5050 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6500 -6.3000 3.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6520 -5.4170 -1.1390 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0750 -5.4910 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5160 -4.3160 -1.2960 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 -5.5000 -1.6200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5000 -3.1510 -2.1100 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2060 -4.7880 -1.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6780 -6.0700 -0.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9850 -6.0270 -0.8040 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3870 -4.7130 -1.0780 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2770 -3.9740 -1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2370 -2.5040 -1.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7680 -4.2290 -1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8280 -7.2920 -0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2970 2.0310 1.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 2.1180 1.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 1.6340 2.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5300 -0.5840 2.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3430 -2.9400 2.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1170 -1.7780 -1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9320 0.5750 -0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 -5.8250 0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3060 -4.5840 2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4080 -6.2150 2.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1020 -5.3480 -0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0320 -5.8810 1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6360 -6.1100 3.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8580 -7.0960 2.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1880 -6.4940 4.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9740 -5.3450 2.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4150 -6.4740 -0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5320 -4.7240 -0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3620 -5.3320 -2.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1950 -1.9250 -0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1330 -2.2320 -2.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3550 -2.2910 -2.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1450 -4.3280 -2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7990 -3.1810 -0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3890 -4.8170 -0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6570 -7.8060 -1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3400 -7.9620 0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8720 -6.9910 -0.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 43 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 44 1 0 0 0 0 15 16 1 0 0 0 0 15 21 1 0 0 0 0 16 17 2 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 27 1 0 0 0 0 26 30 2 0 0 0 0 27 28 2 0 0 0 0 27 33 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 32 1 0 0 0 0 30 31 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 33 59 1 0 0 0 0 33 60 1 0 0 0 0 33 61 1 0 0 0 0 M END