NIH-ZINC06577500 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 56 0 0 1 0 0 0 0 0999 V2000 -0.0650 1.4580 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -0.0480 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 -0.6840 1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1690 -2.1840 1.3080 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0110 -2.4720 1.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3270 -2.7750 -0.0190 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -2.0780 -1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3770 -2.8940 -2.1710 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 -4.1220 -1.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 -4.0850 -0.3780 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 -5.3160 -2.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9670 -5.3460 -3.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 -6.5790 -4.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4820 -7.5530 -3.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3240 -6.9150 -1.8920 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 -0.7240 -1.1770 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1130 -2.6750 1.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0910 -3.3780 3.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2950 -3.8110 3.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4690 -3.5300 2.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4530 -2.8590 1.8490 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3270 -2.4270 1.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 0.0920 2.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3430 0.3520 2.8140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8650 0.5430 2.9850 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7480 1.3810 4.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3040 1.2140 4.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 2.0420 6.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 3.0390 6.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5680 3.2110 5.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6850 2.3890 4.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7160 2.5610 3.4500 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6390 3.6140 3.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9510 1.8520 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 1.7990 -0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 1.8120 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 -4.4740 -4.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 -6.7450 -5.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7240 -8.5760 -3.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 -0.2730 -1.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 -3.5840 3.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3150 -4.3620 4.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4110 -3.8640 3.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3530 -1.8760 0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7420 0.2880 2.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 0.4360 4.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 1.9110 6.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 3.6830 7.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2950 3.9900 5.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1010 3.4360 4.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1090 4.5660 3.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4100 3.6410 2.9670 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 2 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 17 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 7 16 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 45 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 46 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 29 30 2 0 0 0 0 29 48 1 0 0 0 0 30 31 1 0 0 0 0 30 49 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 50 1 0 0 0 0 33 51 1 0 0 0 0 33 52 1 0 0 0 0 M END