NIH-ZINC04042849 MOE2007 3D CORINA 3.40 0006 02.08.2006 65 68 0 0 1 0 0 0 0 0999 V2000 -1.2570 0.3740 -0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1630 -0.4980 -0.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3830 -1.2330 0.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6160 -2.0630 1.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8550 -2.1310 0.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0830 -1.4070 -0.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0740 -0.6040 -1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 0.1320 -2.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2060 -0.3040 -3.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9600 0.3950 -4.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4660 1.6830 -4.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 2.3390 -5.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4590 1.7170 -6.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 0.4420 -6.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 -0.2150 -5.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3590 -2.8340 2.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -4.1500 2.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 -5.0440 3.7500 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7550 -5.0210 4.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2190 -6.3890 3.1920 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1560 -6.4250 1.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 -7.3920 1.0810 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -5.0170 1.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -4.7110 0.1710 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 -7.5920 4.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7930 -8.1130 4.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5190 -9.5760 6.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2330 -10.1180 4.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -4.6940 4.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -4.6020 5.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4520 -4.3050 6.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6560 -4.1020 6.0900 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7140 -4.1890 4.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6210 -4.4830 3.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4020 -2.0420 3.6570 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9090 1.4080 -1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5750 0.0070 -1.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1350 0.3800 -0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3420 -1.1650 1.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6500 -2.7550 1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0610 -1.4850 -0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2050 -0.0400 -2.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1620 -1.3900 -3.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0500 2.1830 -3.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6170 3.3360 -6.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 2.2290 -7.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3370 -0.0400 -7.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 -1.2040 -5.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 -8.3580 3.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -7.3790 5.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4450 -7.4680 4.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2010 -8.1760 3.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1930 -8.9160 6.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4790 -9.2650 6.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6260 -10.6120 6.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4080 -10.1300 3.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9840 -9.5130 4.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2230 -11.1420 4.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3680 -4.7610 6.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4340 -4.2210 7.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6940 -4.0120 4.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7550 -4.5440 2.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -2.5180 4.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8750 -9.5110 4.6380 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.2040 -10.1040 4.1290 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 16 1 0 0 0 0 5 6 2 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 13 14 2 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 47 1 0 0 0 0 15 48 1 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 29 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 64 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 27 64 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 28 64 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 59 1 0 0 0 0 31 32 1 0 0 0 0 31 60 1 0 0 0 0 32 33 2 0 0 0 0 33 34 1 0 0 0 0 33 61 1 0 0 0 0 34 62 1 0 0 0 0 35 63 1 0 0 0 0 64 65 1 0 0 0 0 M CHG 1 64 1 M END