NIH-ZINC04035648 MOE2007 3D CORINA 3.40 0006 02.08.2006 76 76 0 0 1 0 0 0 0 0999 V2000 7.7680 3.4610 7.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5400 3.6980 6.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9850 4.2640 5.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8540 2.4620 6.5050 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8540 2.1830 7.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1880 0.8420 7.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1170 0.5430 8.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4800 -0.7410 7.9160 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4990 -1.2110 8.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 -0.5710 9.6790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 -2.5320 8.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 -2.8990 9.5260 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8360 -2.0860 9.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8800 -4.1760 9.1520 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5170 -4.4780 9.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7300 -3.9200 7.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1970 -4.0950 6.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9740 -3.8610 5.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2890 -3.4490 5.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8260 -3.2730 6.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0440 -3.5150 8.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1160 -2.8680 7.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5990 -2.7080 8.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0540 -3.2180 4.5940 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4360 -3.4190 3.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -5.2180 8.8680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6480 -3.1260 10.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8550 -3.0060 10.8060 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -3.4630 11.9310 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 -3.6840 13.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2190 -4.0520 14.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5660 -4.2830 15.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3390 -4.6260 16.6390 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 -4.8630 17.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3820 -3.5520 18.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 -5.8820 18.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4350 2.7520 7.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2910 4.4040 7.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4510 3.0580 8.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8730 4.4070 7.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6530 3.5550 4.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1110 4.4330 4.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5080 5.2080 5.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3150 2.1350 8.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1030 2.9730 7.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7270 0.8890 6.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9390 0.0520 7.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5780 0.4960 9.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 1.3330 8.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7640 -1.2520 7.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 -2.4530 7.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6080 -3.3040 8.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 -4.4160 6.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5550 -3.9980 4.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4590 -3.3830 9.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9980 -1.9600 8.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6390 -2.3830 8.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5290 -3.6590 8.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5770 -2.7560 3.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1070 -4.4550 3.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1540 -3.2010 2.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 -5.0170 8.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9670 -3.5590 11.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4610 -4.4970 13.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 -2.7740 13.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -3.2390 14.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 -4.9620 14.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2770 -5.0950 15.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 -3.3730 15.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 -5.2530 17.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -3.7330 19.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9630 -2.8260 18.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6230 -3.1620 18.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5810 -6.8160 18.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 -6.0630 19.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 -5.4920 18.8630 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 4 1 0 0 0 0 2 40 1 0 0 0 0 3 41 1 0 0 0 0 3 42 1 0 0 0 0 3 43 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 44 1 0 0 0 0 5 45 1 0 0 0 0 6 7 1 0 0 0 0 6 46 1 0 0 0 0 6 47 1 0 0 0 0 7 8 1 0 0 0 0 7 48 1 0 0 0 0 7 49 1 0 0 0 0 8 9 1 0 0 0 0 8 50 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 51 1 0 0 0 0 11 52 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 27 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 26 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 53 1 0 0 0 0 18 19 1 0 0 0 0 18 54 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 55 1 0 0 0 0 22 23 1 0 0 0 0 23 56 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 59 1 0 0 0 0 25 60 1 0 0 0 0 25 61 1 0 0 0 0 26 62 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 63 1 0 0 0 0 30 31 1 0 0 0 0 30 64 1 0 0 0 0 30 65 1 0 0 0 0 31 32 1 0 0 0 0 31 66 1 0 0 0 0 31 67 1 0 0 0 0 32 33 1 0 0 0 0 32 68 1 0 0 0 0 32 69 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 34 70 1 0 0 0 0 35 71 1 0 0 0 0 35 72 1 0 0 0 0 35 73 1 0 0 0 0 36 74 1 0 0 0 0 36 75 1 0 0 0 0 36 76 1 0 0 0 0 M END