NIH-ZINC04056994 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 63 0 0 1 0 0 0 0 0999 V2000 -1.3230 0.7280 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5720 -0.4800 -0.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4370 -0.5830 -1.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 -1.7810 -1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2090 -2.0150 -1.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5970 -1.0630 -2.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8630 0.1350 -2.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 0.3790 -1.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6490 -1.2860 -3.7170 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6270 -0.7540 -5.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0490 -1.8280 -6.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2790 -3.0550 -4.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8660 -1.9800 -3.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8720 -3.4830 -6.7760 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1170 -4.2770 -6.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2650 -4.0780 -6.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7810 -5.0200 -7.3790 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1170 -6.2040 -7.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1180 -6.5570 -7.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6630 -7.0490 -8.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5150 -8.4350 -8.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0030 -9.2640 -9.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6280 -8.7100 -10.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7590 -7.3260 -10.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2730 -6.4910 -9.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9140 -2.9080 -8.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0980 -3.4340 -9.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1610 -2.9120 -10.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0440 -1.8750 -10.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8500 -1.3420 -9.7790 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7690 -1.8680 -8.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 1.5880 0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8420 0.8700 -1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0830 0.6500 0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8710 -2.5470 -0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7070 -2.9790 -1.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1310 0.9260 -3.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 1.3320 -2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6290 -0.4070 -5.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3060 0.1050 -5.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3190 -2.6440 -6.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1540 -1.3640 -7.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2570 -3.4470 -4.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5460 -3.8670 -4.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6700 -1.2380 -3.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7790 -2.4430 -2.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0150 -3.2880 -6.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2090 -4.6260 -5.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6460 -4.8030 -7.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0250 -8.8760 -7.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8930 -10.3420 -9.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0050 -9.3580 -11.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2340 -6.9000 -11.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3540 -5.4150 -9.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4160 -4.2590 -8.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5390 -3.3090 -11.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1310 -1.4320 -11.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4430 -1.4040 -7.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3990 -2.4560 -5.7170 N 0 3 0 0 0 0 0 0 0 0 0 0 6.0870 -1.6940 -5.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 11 59 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 12 59 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 26 1 0 0 0 0 14 59 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 49 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 23 24 2 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 25 54 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 55 1 0 0 0 0 28 29 1 0 0 0 0 28 56 1 0 0 0 0 29 30 2 0 0 0 0 29 57 1 0 0 0 0 30 31 1 0 0 0 0 31 58 1 0 0 0 0 59 60 1 0 0 0 0 M CHG 1 59 1 M END