NIH-ZINC04101439 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 62 0 0 1 0 0 0 0 0999 V2000 1.6270 2.5340 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0170 1.1470 0.2060 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0460 1.2470 0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 0.3110 -1.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 -1.0300 -0.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -1.8530 -2.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -2.7080 -2.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9060 -3.4630 -3.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9900 -3.3640 -4.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 -2.5100 -4.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2580 -1.7580 -3.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 0.4840 1.3280 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 0.7150 2.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 1.4720 2.7980 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9660 0.0340 3.7440 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0190 0.3140 3.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 0.4640 5.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 -0.2020 6.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9060 -1.7240 6.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 -2.1300 4.7840 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 -1.4850 3.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3560 -3.0760 4.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7750 -3.3890 3.5700 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8890 -3.7280 5.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2270 -3.8750 7.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0890 -4.5530 7.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2700 -4.8120 7.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1360 -4.3030 5.9870 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1530 -4.3640 4.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2080 -5.4870 8.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8240 -5.7670 9.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1940 -5.1820 9.5860 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6900 2.4340 -0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 3.0270 -0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4970 3.1290 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 0.8460 -1.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2620 0.1360 -1.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9030 -1.5650 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 -0.8550 -0.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4570 -2.7860 -1.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7500 -4.1310 -3.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 -3.9530 -5.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 -2.4320 -5.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1040 -1.0930 -3.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4270 -0.1210 1.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3740 1.5470 5.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2620 0.1620 5.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0820 0.0800 6.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5760 0.1230 7.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -2.2040 6.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8610 -2.0150 6.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7920 -1.7580 3.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 -1.8080 2.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2270 -3.5330 7.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7260 -3.4360 4.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8230 -5.2030 5.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6680 -4.4970 3.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1820 -5.7640 7.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4300 -6.2840 10.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 9 10 2 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 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 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 21 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 54 1 0 0 0 0 26 27 2 0 0 0 0 26 32 1 0 0 0 0 27 28 1 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 30 31 2 0 0 0 0 30 58 1 0 0 0 0 31 32 1 0 0 0 0 31 59 1 0 0 0 0 M END