NIH-ZINC03957855 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 70 0 0 1 0 0 0 0 0999 V2000 2.0290 -9.8040 -7.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3840 -10.2270 -6.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4110 -9.2540 -6.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2530 -9.5550 -4.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 -8.4530 -4.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9780 -8.7750 -3.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9480 -7.7200 -2.9040 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6970 -7.7920 -1.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5680 -8.7310 -1.0290 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6950 -6.7060 -1.4760 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2040 -5.7350 -1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8190 -6.7550 -2.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9660 -5.7370 -3.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9960 -5.7820 -4.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8790 -6.8450 -4.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7320 -7.8640 -3.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6990 -7.8210 -2.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0030 -6.8940 -5.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2340 -6.9090 -0.1280 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7470 -8.2240 0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2240 -8.5780 1.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8410 -9.5700 2.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3640 -9.8990 3.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2650 -9.2350 4.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6440 -8.2360 3.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1240 -7.9150 2.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5970 -7.7400 4.1260 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3350 -8.7220 5.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6090 -9.3650 5.3370 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2580 -5.8860 0.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7380 -6.0440 1.8510 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6890 -4.5460 0.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7920 -3.6240 1.4930 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3420 -2.3590 1.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8530 -1.9840 0.3310 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4480 -1.4100 2.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7700 -10.5460 -8.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2610 -9.7300 -8.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5130 -8.8360 -7.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -11.1950 -6.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1510 -10.3010 -5.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 -10.5100 -4.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 -9.6150 -4.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7480 -7.4980 -4.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0000 -8.3930 -5.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4960 -9.7300 -3.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 -8.8350 -2.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0520 -6.9690 -3.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2760 -4.9060 -3.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1120 -4.9860 -5.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4220 -8.6950 -3.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5810 -8.6190 -1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6670 -7.4110 -6.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8520 -7.4260 -4.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3050 -5.8780 -5.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8370 -8.1960 0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4180 -8.9720 -0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6980 -10.0890 1.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8480 -10.6750 4.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6400 -7.1440 1.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5910 -9.4410 4.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0060 -8.2400 6.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6420 -4.6640 0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2480 -4.1460 -0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1830 -3.9240 2.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5460 -1.4800 3.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5580 -0.3910 2.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3150 -1.6730 3.1460 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 40 1 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 42 1 0 0 0 0 4 43 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 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 19 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 49 1 0 0 0 0 14 15 1 0 0 0 0 14 50 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 51 1 0 0 0 0 17 52 1 0 0 0 0 18 53 1 0 0 0 0 18 54 1 0 0 0 0 18 55 1 0 0 0 0 19 20 1 0 0 0 0 19 30 1 0 0 0 0 20 21 1 0 0 0 0 20 56 1 0 0 0 0 20 57 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 58 1 0 0 0 0 23 24 1 0 0 0 0 23 59 1 0 0 0 0 24 25 2 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 60 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 61 1 0 0 0 0 28 62 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 32 63 1 0 0 0 0 32 64 1 0 0 0 0 33 34 1 0 0 0 0 33 65 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 36 66 1 0 0 0 0 36 67 1 0 0 0 0 36 68 1 0 0 0 0 M END