NIH-ZINC04388559 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 66 0 0 1 0 0 0 0 0999 V2000 0.9780 -2.3600 -2.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 -1.0550 -2.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5670 -0.4030 -1.0820 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3700 -1.1020 -0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 0.8420 -0.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 1.9180 -0.7620 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6040 0.7590 -0.8440 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4070 1.9690 -0.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8690 1.6060 -0.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5910 1.2720 0.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9060 1.0100 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9090 1.1990 -1.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6740 1.5650 -1.7190 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9890 -0.0500 -1.0890 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8430 -0.5610 -0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5680 -1.7190 -0.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4100 -2.2220 0.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5310 -1.5730 1.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8120 -0.4180 2.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9700 0.0950 1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2670 1.2340 1.3580 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4480 1.8530 2.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4750 0.7670 -2.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7360 1.2100 -2.8980 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9370 1.1310 -2.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2130 2.0230 -3.1810 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6310 2.8770 -3.2340 S 0 0 0 0 0 0 0 0 0 0 0 0 5.6120 3.6100 -4.4510 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7780 3.4900 -1.9600 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9400 1.7070 -3.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3740 1.3060 -4.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4010 0.3880 -4.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9940 -0.1290 -3.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5610 0.2730 -2.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5370 1.1940 -2.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1140 -1.1310 -3.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0430 -2.1400 -2.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7930 -3.0050 -1.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 -2.8660 -3.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4450 -0.3780 -3.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8730 -1.2670 -2.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0400 -0.1020 -0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1430 2.4340 0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2100 2.6680 -1.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2350 1.2150 1.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7470 0.7140 0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7610 1.0800 -1.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4740 -2.2280 -1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9740 -3.1230 0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1900 -1.9700 2.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9090 0.0860 3.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4960 2.1240 2.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8300 2.7490 2.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1550 1.1570 3.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1910 1.6350 -1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5360 0.2250 -2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5650 2.1130 -3.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9100 1.7100 -5.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7390 0.0740 -5.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0250 -0.1310 -1.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2010 1.5110 -1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0680 -0.6060 -3.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1010 -1.7980 -2.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9810 -1.7130 -4.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 40 1 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 14 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 8 43 1 0 0 0 0 8 44 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 45 1 0 0 0 0 11 12 2 0 0 0 0 11 46 1 0 0 0 0 12 13 1 0 0 0 0 12 47 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 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 50 1 0 0 0 0 19 20 1 0 0 0 0 19 51 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 22 54 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 55 1 0 0 0 0 25 56 1 0 0 0 0 26 27 1 0 0 0 0 26 57 1 0 0 0 0 27 28 2 0 0 0 0 27 29 2 0 0 0 0 27 30 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 58 1 0 0 0 0 32 33 1 0 0 0 0 32 59 1 0 0 0 0 33 34 2 0 0 0 0 33 36 1 0 0 0 0 34 35 1 0 0 0 0 34 60 1 0 0 0 0 35 61 1 0 0 0 0 36 62 1 0 0 0 0 36 63 1 0 0 0 0 36 64 1 0 0 0 0 M END