NIH-ZINC04040190 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 66 0 0 1 0 0 0 0 0999 V2000 0.2630 1.5450 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 0.0890 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 -0.7180 1.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 -2.0120 0.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 -2.0060 -0.3750 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7960 -2.8060 -0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3110 -0.7510 -0.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3290 -0.4520 -2.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 0.6320 -2.8170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 -1.5830 -3.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6900 -1.4080 -4.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 -3.2670 1.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -0.3190 2.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6810 -0.1970 3.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3110 0.1210 5.1580 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1700 1.1060 5.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6010 0.2550 5.8390 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6710 -0.0350 5.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8550 0.0010 5.3340 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1390 -0.3480 3.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8560 -0.6470 2.7230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7090 0.6280 7.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6620 1.8060 7.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9940 2.6310 7.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4220 2.1560 6.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9380 1.4440 7.9060 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1590 0.2740 8.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7110 0.6430 8.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5550 -0.9400 5.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7710 -0.6050 6.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5630 -1.6010 6.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1130 -2.9090 6.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 -3.2750 6.3420 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 -2.2880 5.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 -0.0750 2.9330 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 1.7010 -0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 2.0730 -0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3210 2.0030 1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 -1.1110 -4.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 -2.3670 -4.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4500 -0.6700 -4.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 -3.2650 2.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 -4.1500 1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 -3.3690 2.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0120 -0.2670 7.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 0.9140 7.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5500 2.1700 8.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4460 2.6270 6.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5780 3.1230 6.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9420 3.2970 7.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0720 3.0200 6.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4780 1.5170 5.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6130 -0.2340 9.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2120 -0.4070 7.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6570 1.2890 9.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1040 -0.2530 8.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1180 0.4250 6.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5130 -1.3640 7.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6960 -3.7210 7.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7270 -2.6350 5.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0070 -0.3200 2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1190 1.4300 7.3540 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.1740 0.8060 6.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 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 13 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 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 11 39 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 29 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 62 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 24 62 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 28 62 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 57 1 0 0 0 0 31 32 1 0 0 0 0 31 58 1 0 0 0 0 32 33 2 0 0 0 0 32 59 1 0 0 0 0 33 34 1 0 0 0 0 34 60 1 0 0 0 0 35 61 1 0 0 0 0 62 63 1 0 0 0 0 M CHG 1 62 1 M END