NIH-ZINC03958847 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 1 0 0 0 0 0999 V2000 1.4920 1.9020 -1.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 0.4180 -1.3340 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0330 0.3540 -1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6550 -0.4540 -2.5350 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2560 -1.4700 -2.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1730 -0.5610 -2.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9350 -1.5850 -1.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3330 -1.3720 -2.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6010 -0.1950 -2.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1740 0.6440 -3.2330 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 0.2730 -3.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8310 0.7130 -5.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9560 -0.5550 -6.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 -1.0500 -4.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 0.1640 -7.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 -0.1320 -0.0320 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0270 -1.3430 0.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 -1.9900 -0.2250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5360 -1.8530 1.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -2.6900 2.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 -3.2140 3.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4450 -2.9340 4.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2530 -2.0970 3.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8160 -1.5650 2.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8870 -3.4580 5.3910 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0350 -4.3300 6.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2180 -3.1570 5.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5520 2.0730 -1.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2510 2.3470 -2.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9330 2.4560 -0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5110 -2.4530 -1.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1060 -2.0490 -1.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5700 0.2110 -3.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5980 1.0870 -3.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9060 -0.6390 -3.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9170 0.8640 -5.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3720 1.6840 -5.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 0.3400 -6.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 -1.3340 -7.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9320 -1.9840 -4.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 -1.2030 -5.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4370 1.0960 -8.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0100 0.3220 -7.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 -0.6020 -8.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1700 0.3960 0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -2.9450 2.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 -3.8570 4.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2620 -1.8430 3.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5100 -0.9570 1.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7740 -5.2370 5.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5310 -4.6560 7.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 -3.8110 6.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3390 -2.0790 6.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4040 -3.6410 6.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9920 -3.5130 5.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 -0.0100 -3.9080 N 0 3 0 0 0 0 0 0 0 0 0 0 1.6030 0.8540 -4.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4870 -0.2800 -6.3750 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 16 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 56 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 11 56 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 12 58 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 13 58 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 14 56 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 15 58 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 56 1 M END