NIH-ZINC05796317 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 0 0 0 0 0 0999 V2000 -1.1100 1.3840 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4470 0.0390 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1570 -0.4280 1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 -1.6650 1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 -2.4480 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 -1.9930 -1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3750 -0.7430 -1.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 -2.7580 -2.3790 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8890 -4.0050 -2.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 -4.3040 -3.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 -3.1980 -4.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 -2.2650 -3.5120 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 -5.5210 -4.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8030 -6.3310 -3.6030 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9710 -5.9340 -2.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 -4.7970 -1.7530 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9400 -5.8930 -5.7760 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4550 -7.1640 -6.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 -7.3290 -7.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 -8.6220 -8.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 -9.7670 -8.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2260 -10.9500 -8.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4840 -10.9890 -9.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3210 -9.8720 -9.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8780 -8.6920 -8.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0360 -12.5130 -10.3790 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4900 -12.4400 -10.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 -13.5550 -9.5680 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4970 -12.4260 -11.8740 N 0 5 0 0 0 0 0 0 0 0 0 0 2.9680 -11.6490 -12.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 2.1480 -0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9550 1.3850 -0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5040 1.6500 0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 0.1690 2.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 -2.0240 2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3700 -3.4000 0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8320 -0.3600 -2.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 -3.0280 -5.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5130 -6.6210 -1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 -5.2820 -6.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5440 -7.2030 -6.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0190 -7.9920 -5.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -7.2640 -7.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5180 -6.4860 -8.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1980 -9.7400 -7.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -11.8270 -8.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3010 -9.9130 -10.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5300 -7.8210 -8.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 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 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 16 2 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 11 12 2 0 0 0 0 11 38 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 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 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 28 2 0 0 0 0 26 29 1 0 0 0 0 29 30 1 0 0 0 0 M CHG 1 29 -1 M END