NIH-ZINC01051308 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 -2.4090 -0.7020 -1.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0820 -0.9230 -0.4680 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 -0.9990 0.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1480 -0.9790 1.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0720 -1.0350 3.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 -1.1020 3.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3210 -1.1060 3.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 -1.0500 1.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -1.0790 -1.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0910 -1.6590 -1.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -0.4900 -2.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3230 -1.2920 -3.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3130 -0.7410 -5.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 0.6100 -5.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 1.4100 -4.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 0.8680 -2.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 1.2420 -6.4680 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1260 0.6990 -7.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3520 -0.4860 -7.9600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 1.7540 -8.8510 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8210 2.5080 -8.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 1.0810 -10.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 1.9320 -11.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 3.0100 -11.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3380 3.4630 -10.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3190 2.4550 -8.9720 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0890 1.6870 -9.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7740 3.3080 -7.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 3.4120 -6.8360 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7830 0.2810 -0.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3990 -0.7520 -2.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0900 -1.4940 -0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1430 -0.9220 1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9840 -1.0240 3.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7760 -1.1440 4.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 -1.1470 3.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 -1.0280 1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5690 -2.3430 -3.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5470 -1.3890 -5.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 2.4670 -4.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 1.5070 -1.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 2.2680 -6.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5030 0.8180 -10.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1130 0.1420 -10.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 1.6420 -12.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 3.5970 -12.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9060 4.4250 -9.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3790 3.6660 -10.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9420 3.7750 -7.8380 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 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 22 1 0 0 0 0 20 26 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 M CHG 1 49 -1 M END