NIH-ZINC06552755 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 57 0 0 1 0 0 0 0 0999 V2000 -1.5420 0.8950 -0.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 -0.1530 -0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -0.7560 -1.4700 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 -1.6970 -1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3530 -2.0440 -0.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6000 -2.2450 -2.4770 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0330 -1.8880 -3.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0750 -1.7910 -2.5420 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5310 -2.2190 -3.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2400 -0.2860 -2.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9100 0.3780 -3.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0190 1.7670 -3.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4590 2.5110 -2.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7930 1.8670 -1.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6850 0.4780 -1.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8310 -2.3530 -1.4550 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5180 -3.7090 -2.4270 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4250 -4.4030 -2.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5610 -3.8640 -3.3890 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -5.9020 -2.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 -6.6620 -3.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4650 -8.1670 -3.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4990 -8.6620 -2.5920 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5350 -8.8420 -3.7360 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7440 -10.2380 -3.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 -11.1830 -3.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1430 -12.5500 -3.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3130 -12.9690 -3.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2010 -12.0450 -4.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9130 -10.6820 -4.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6630 -14.7360 -4.1200 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.4670 -14.8070 -5.3370 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3270 -15.3140 -4.2380 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4430 -15.1240 -2.7900 N 0 5 0 0 0 0 0 0 0 0 0 0 -4.3120 -14.6290 -2.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0410 1.6540 -1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3150 0.4410 -1.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0230 1.3860 0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 0.3210 0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0690 -0.9180 0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5640 -0.1810 -4.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7600 2.2680 -4.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5440 3.5920 -2.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1400 2.4450 -0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9560 0.0020 -0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2840 -2.3120 -0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2970 -4.2120 -2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4980 -6.2150 -3.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 -6.1230 -1.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5440 -6.3550 -2.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7220 -6.4320 -4.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2550 -8.2740 -4.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -10.8900 -2.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 -13.2790 -2.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1080 -12.3780 -5.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6180 -9.9750 -4.8580 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 39 1 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 17 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 16 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 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 13 14 2 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 15 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 47 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 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 30 56 1 0 0 0 0 31 32 2 0 0 0 0 31 33 2 0 0 0 0 31 34 1 0 0 0 0 34 35 1 0 0 0 0 M CHG 1 34 -1 M END