NIH-ZINC02852524 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.9200 -2.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 -1.3660 -3.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0020 -1.3810 -3.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7360 -0.9500 -2.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0890 -0.5000 -1.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 -0.4890 1.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 -0.9020 2.5490 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8170 -1.3600 3.4960 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0330 0.1720 2.8050 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1380 -2.2940 2.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6430 -3.5740 2.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4270 -4.6660 1.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7050 -4.4780 1.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2000 -3.1990 1.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 -2.1070 1.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5590 -5.6690 1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3690 -6.0970 2.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2230 -7.2870 2.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1870 -7.7480 0.8920 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0260 -7.8400 2.9430 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8680 -9.0020 2.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6290 -10.0850 3.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8740 -8.4540 5.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0800 -7.3000 4.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7930 -10.5600 6.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 -0.9090 -2.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -1.7030 -4.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5070 -1.7300 -4.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8150 -0.9620 -2.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6630 -0.1600 -0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6770 -0.5690 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -3.7210 2.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0400 -5.6660 2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1980 -3.0520 0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8060 -1.1070 1.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2380 -5.4020 0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9200 -6.4930 0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6900 -6.3640 3.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0080 -5.2730 2.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9170 -8.7080 2.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6000 -9.3860 1.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3240 -10.9090 3.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6060 -10.4520 3.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8620 -8.8460 5.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0200 -8.0920 6.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2920 -6.5590 4.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0530 -6.8390 4.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8170 -11.0440 6.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5700 -11.3000 5.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9540 -10.1110 7.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8430 -9.5150 5.0150 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 58 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 58 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 M END