NIH-ZINC00277021 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 0.1060 1.5460 -0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 0.0270 -0.3860 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2240 -0.2270 -1.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 -0.6600 0.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9470 -2.1740 0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4570 -2.6740 0.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5440 -1.9930 -0.1330 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4690 -2.3240 -1.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 -0.4610 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1440 -3.9500 0.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5340 -4.3590 0.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5810 -3.6380 0.1340 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4590 -2.1820 0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0890 -1.7590 -0.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6370 -4.2940 -0.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1970 -5.4560 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2670 -6.1200 -0.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8070 -5.6370 -1.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2760 -4.4880 -2.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2060 -3.8320 -1.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6970 -3.9040 -3.4630 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7800 -4.5290 -4.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 1.9000 -0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6140 2.0430 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1000 1.8660 0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0590 -0.3430 0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9090 -0.3640 1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 -2.4830 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6730 -2.6450 1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4570 -3.7560 0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6560 -2.5060 1.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6900 -0.1170 0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0910 0.0190 -0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3900 -4.3980 0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9910 -4.2730 -0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6180 -5.4460 0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6150 -4.1340 1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2490 -1.6850 -0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5630 -1.8180 1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9640 -2.0450 -1.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9910 -0.6780 -0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8280 -5.8520 1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6830 -7.0130 -0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6360 -6.1770 -2.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8000 -2.9550 -2.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5150 -5.5440 -4.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6850 -4.5290 -3.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9910 -3.9450 -5.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9450 -2.4250 0.3610 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.0290 -2.1210 1.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 49 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 10 49 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 14 49 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 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 49 1 M END