NIH-ZINC06551010 MOE2007 3D CORINA 3.40 0006 02.08.2006 70 72 0 0 1 0 0 0 0 0999 V2000 0.1730 1.4930 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 -0.0130 -0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4260 -0.6930 -1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 -2.0730 -1.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -2.7780 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5690 -2.0930 1.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 -0.7130 0.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -4.1770 -0.0620 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 -4.8600 -1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 -4.2720 -2.2750 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 -6.3550 -1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2050 -6.9760 -2.9200 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.3040 -6.4350 -3.6400 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4420 -8.7620 -2.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 -9.4330 -4.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 -8.7860 -5.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6990 -10.7530 -4.1530 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 -11.5520 -2.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0170 -13.0420 -3.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4100 -13.4970 -2.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2390 -12.1900 -2.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2110 -11.1540 -2.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7840 -11.3890 -5.4700 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6450 -10.6360 -6.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1580 -12.0420 -5.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2890 -12.4400 -5.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 -12.6380 -4.6680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 -13.1590 -6.7250 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4460 -14.1810 -6.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 -14.3990 -8.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8720 -15.4660 -8.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3720 -16.7770 -7.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0360 -16.5600 -6.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9460 -15.4930 -6.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7390 1.8920 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 1.8300 0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2610 1.8450 -1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8130 -0.1440 -2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9030 -2.6030 -2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9570 -2.6390 1.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 -0.1800 1.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 -4.6540 0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5730 -6.8200 -0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1890 -6.5980 -0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 -9.1670 -2.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3950 -8.9450 -2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 -11.4040 -2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 -13.1700 -4.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 -13.6170 -2.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8490 -14.1980 -3.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3420 -13.9470 -1.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5940 -11.9160 -3.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0720 -12.2900 -2.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1110 -11.2260 -1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5050 -10.1460 -2.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3350 -12.7280 -4.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9290 -11.2710 -5.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1900 -12.5920 -6.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2060 -13.0000 -7.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3390 -13.8510 -6.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8890 -14.7280 -8.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1380 -13.4640 -8.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1110 -15.6210 -9.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7650 -15.1360 -7.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 -17.1070 -8.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1480 -17.5380 -7.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6800 -17.4940 -5.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9290 -16.2300 -5.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -15.3370 -5.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -15.8220 -6.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 42 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 43 1 0 0 0 0 11 44 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 22 54 1 0 0 0 0 22 55 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 25 56 1 0 0 0 0 25 57 1 0 0 0 0 25 58 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 59 1 0 0 0 0 29 30 1 0 0 0 0 29 34 1 0 0 0 0 29 60 1 0 0 0 0 30 31 1 0 0 0 0 30 61 1 0 0 0 0 30 62 1 0 0 0 0 31 32 1 0 0 0 0 31 63 1 0 0 0 0 31 64 1 0 0 0 0 32 33 1 0 0 0 0 32 65 1 0 0 0 0 32 66 1 0 0 0 0 33 34 1 0 0 0 0 33 67 1 0 0 0 0 33 68 1 0 0 0 0 34 69 1 0 0 0 0 34 70 1 0 0 0 0 M END