NIH-ZINC02972760 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 67 0 0 1 0 0 0 0 0999 V2000 2.4250 -2.4400 -5.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 -2.4050 -4.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 -1.7800 -4.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 -1.7130 -3.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5890 -2.2730 -2.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6410 -2.8690 -1.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6130 -2.9340 -2.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8350 -2.1810 -0.8740 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.2410 -2.5660 0.3890 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5350 -0.9260 -1.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8980 -3.4180 -1.3440 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4150 -4.8200 -1.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6060 -5.8260 -1.2690 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1330 -5.6560 -0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5730 -5.5920 -2.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9120 -5.2700 -2.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7840 -5.0370 -3.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2870 -5.1340 -4.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0050 -5.4440 -4.8020 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1820 -5.6660 -3.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2300 -8.3260 -1.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6740 -9.7600 -1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8440 -9.9910 -0.1570 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 -9.0220 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3470 -7.5920 0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0220 -11.1160 0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1490 -12.3770 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3100 -13.5470 0.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3520 -13.4830 2.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2400 -12.2500 2.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0810 -11.0660 2.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0220 -9.8150 2.6320 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0920 -9.7470 4.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0510 -1.5450 -5.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0600 -3.3250 -5.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9800 -2.4850 -6.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 -1.3310 -5.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7890 -1.2160 -3.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 -3.2770 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5750 -3.3930 -2.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5670 -3.1210 -2.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 -4.9870 -2.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7440 -4.9620 -0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2900 -5.1890 -1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8230 -4.7830 -3.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9240 -4.9560 -5.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1650 -5.9120 -4.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7340 -8.1440 -2.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9240 -8.1610 -0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5260 -10.4500 -1.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0720 -9.9260 -2.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2530 -9.2190 1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0320 -9.1030 -0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0600 -7.4380 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 -6.8840 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0930 -12.4580 -1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3940 -14.5070 0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4750 -14.3920 2.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2890 -12.2520 3.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0520 -10.1240 4.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2500 -10.2710 4.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0210 -8.6920 4.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0970 -7.2900 -1.1830 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.4420 -7.4520 -1.9590 H 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 63 64 1 0 0 0 0 M CHG 1 63 1 M END