NIH-ZINC02972760 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 66 0 0 1 0 0 0 0 0999 V2000 2.2640 -2.6240 -5.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 -2.5020 -4.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 -1.7190 -4.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 -1.6070 -3.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 -2.2780 -2.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -3.0620 -2.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5030 -3.1770 -3.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6790 -2.1340 -1.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 -2.4310 0.1660 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 -0.9120 -1.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7950 -3.3440 -1.2090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3830 -4.7450 -1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6220 -5.6300 -0.9420 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2080 -5.2940 -0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4590 -5.5380 -2.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5780 -4.7200 -2.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3190 -4.6660 -3.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9190 -5.4250 -4.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8490 -6.1910 -4.4130 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1180 -6.2620 -3.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3720 -7.9140 -0.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8950 -9.3620 -0.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0540 -9.4860 0.6870 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8880 -8.5960 0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3640 -7.1480 0.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6570 -10.8140 0.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 -11.4710 -0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5250 -12.7820 0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8730 -13.4410 1.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6120 -12.7920 2.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0020 -11.4770 2.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7240 -10.8350 3.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0410 -11.5770 4.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0180 -1.8410 -5.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7480 -3.6000 -5.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 -2.5200 -6.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -1.1950 -5.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6360 -0.9950 -3.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 -3.5860 -1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3830 -3.7920 -3.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7210 -3.1250 -1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8330 -5.0380 -1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7440 -4.8640 -0.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8670 -4.1390 -1.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1960 -4.0410 -3.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4910 -5.3890 -5.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2450 -6.8980 -3.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9720 -7.8130 -1.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9730 -7.6450 0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7580 -10.0220 -0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3170 -9.6400 -1.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 -8.6960 1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 -8.8640 -0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9430 -6.8700 1.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5010 -6.4880 0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6430 -10.9590 -0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9480 -13.2930 -0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5660 -14.4660 1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8810 -13.3100 3.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6270 -12.4560 3.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1190 -11.8920 4.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6180 -10.9500 4.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2060 -7.0230 -0.7330 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 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 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 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 39 1 0 0 0 0 7 40 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 63 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 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 21 63 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 25 63 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 56 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 29 30 2 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 30 59 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 60 1 0 0 0 0 33 61 1 0 0 0 0 33 62 1 0 0 0 0 M END