NIH-ZINC03895701 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 65 0 0 1 0 0 0 0 0999 V2000 1.9880 1.0840 2.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6030 -0.3430 2.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 -1.3620 2.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0650 -2.7960 2.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2750 -3.0300 1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4810 -2.0080 0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8080 -0.5730 0.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8770 -4.4500 0.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 -5.2030 1.4170 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3050 -4.8050 -0.5750 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0020 -6.0940 -1.1820 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8520 -6.8270 -0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7490 -6.0680 -2.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 -5.9100 -1.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 -4.9840 -3.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2450 -6.5330 -1.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0690 -5.7290 -2.4090 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3290 -7.8980 -2.1880 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4320 -8.4630 -2.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1980 -9.9330 -3.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3660 -10.4900 -4.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4990 -12.6120 -4.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2860 -14.1080 -5.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2480 -14.3380 -5.9700 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9990 -13.8090 -5.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0820 -12.2950 -5.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0460 1.2800 2.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 1.8120 1.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8110 1.2590 3.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5370 -0.4770 2.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4800 -1.1920 2.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1960 -1.2280 4.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 -3.4920 3.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0230 -3.0080 2.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3440 -2.9140 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6910 -2.1320 -0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4050 -2.1880 0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 0.1170 0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8470 -0.3500 0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8780 -4.1670 -1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 -7.0360 -2.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 -4.9270 -0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4170 -6.0170 -1.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 -6.6770 -0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6930 -5.1060 -3.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 -5.0400 -3.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8390 -3.9790 -2.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6180 -8.5080 -1.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5620 -7.8780 -3.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3370 -8.3390 -2.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0710 -10.5040 -2.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2600 -10.0240 -3.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4720 -9.9980 -5.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2980 -10.3730 -3.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2490 -12.4330 -4.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7800 -12.1050 -5.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2050 -14.5570 -5.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0390 -14.6220 -4.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2480 -14.0370 -6.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 -14.3180 -4.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3390 -11.7830 -6.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1410 -11.9120 -4.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1900 -11.9750 -4.3210 N 0 3 0 0 0 0 0 0 0 0 0 0 4.9440 -12.4140 -3.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 30 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 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 41 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 21 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 21 63 1 0 0 0 0 22 23 1 0 0 0 0 22 55 1 0 0 0 0 22 56 1 0 0 0 0 22 63 1 0 0 0 0 23 24 1 0 0 0 0 23 57 1 0 0 0 0 23 58 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 59 1 0 0 0 0 25 60 1 0 0 0 0 26 61 1 0 0 0 0 26 62 1 0 0 0 0 26 63 1 0 0 0 0 63 64 1 0 0 0 0 M CHG 1 63 1 M END