NIH-ZINC04434982 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 1 0 0 0 0 0999 V2000 0.2040 1.0690 0.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -0.4520 0.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4210 -2.3200 0.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9040 -2.6960 0.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3890 -0.7370 -0.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9060 -0.3600 -0.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9310 -2.6050 -0.8630 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.4920 -2.1480 -0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0270 -4.1050 -0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9640 -4.7710 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8500 -6.1490 -0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8210 -6.6030 -0.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9260 -5.2460 -1.5200 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.5130 -2.1470 -2.2020 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.4830 -1.0590 -2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9620 -2.6240 -2.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7230 -2.7150 -3.2980 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6940 -2.1000 -4.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3230 -1.0740 -4.6690 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8970 -2.6720 -5.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8590 -2.0430 -6.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0980 -2.6200 -7.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4060 -3.7890 -7.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4610 -4.3600 -6.4020 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1660 -3.8460 -5.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 1.3710 0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 1.5410 -0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3200 1.3770 1.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 -0.7610 -0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5830 -0.9250 1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9670 -2.6640 1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9190 -2.7900 -0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0050 -3.7810 0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4010 -2.2500 1.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8920 -0.2680 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8430 -0.3930 -1.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 -0.8080 -1.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8060 0.7240 -0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7520 -4.2720 0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5420 -6.8080 0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5760 -7.6450 -0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5660 -2.1430 -1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3530 -2.3640 -3.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0010 -3.7050 -2.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2210 -3.5330 -3.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4090 -1.1310 -7.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0440 -2.1630 -8.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8110 -4.2410 -8.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1830 -4.3400 -4.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 -0.8600 0.3740 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5220 -2.1970 -0.7770 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 2 50 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 50 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 4 51 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 5 51 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 6 50 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 14 1 0 0 0 0 7 51 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 39 1 0 0 0 0 11 12 2 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 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 25 2 0 0 0 0 21 22 2 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 25 49 1 0 0 0 0 M END