NIH-ZINC04103560 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 71 0 0 1 0 0 0 0 0999 V2000 3.2020 -1.7180 2.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8880 -2.8040 1.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8350 -2.3690 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7220 -1.3160 -0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2040 -1.7690 -0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5570 -3.5430 -0.9480 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4300 -3.7020 -2.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2430 -4.9890 -2.5550 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2150 -5.6170 -1.3510 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 -4.7550 -0.3710 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5170 -2.6510 -3.4010 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6190 -1.6910 -2.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 -2.5480 -4.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 -3.7880 -5.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -2.0930 -3.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0300 -4.0290 -5.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4750 -4.5080 -4.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6860 -5.7940 -5.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0470 -6.1890 -5.6220 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2420 -6.3930 -4.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1980 -1.5060 -5.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7080 -0.3500 -4.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0050 -0.1790 -3.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4630 0.9990 -3.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8120 1.1860 -2.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2250 2.3300 -2.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2740 3.2960 -1.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9250 3.1150 -2.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5280 1.9690 -2.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1790 1.7810 -3.1260 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4950 2.4790 -2.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7130 0.6820 -3.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5230 0.5310 -4.0630 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6780 2.5520 -1.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1820 -1.2670 2.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4450 -0.9300 2.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2180 -2.1590 3.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6440 -3.5910 1.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9250 -3.2520 1.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8730 -0.4570 0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6810 -0.9030 -1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -1.7450 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0110 -2.4880 -0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2590 -1.4840 -1.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4230 -0.8620 0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 -1.7520 -5.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6410 -4.6550 -4.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1090 -3.5940 -5.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5590 -4.0540 -5.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -1.1310 -2.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8550 -1.9560 -4.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 -2.8230 -2.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7580 -3.8020 -6.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3650 -4.8030 -4.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1730 -3.7440 -5.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7410 -4.6820 -3.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0610 -6.6070 -5.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4460 -5.6460 -6.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3430 -1.2470 -5.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9910 -1.8070 -5.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7610 -0.8950 -4.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5520 0.4450 -3.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5820 4.1990 -1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2050 3.8740 -1.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1550 3.0920 -2.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8000 3.1320 -0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1970 1.5990 -1.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8410 -2.7580 -4.2120 N 0 3 0 0 0 0 0 0 0 0 0 0 4.5620 -2.8090 -3.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 38 1 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 5 43 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 10 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 68 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 46 1 0 0 0 0 14 47 1 0 0 0 0 14 48 1 0 0 0 0 14 49 1 0 0 0 0 15 50 1 0 0 0 0 15 51 1 0 0 0 0 15 52 1 0 0 0 0 16 17 1 0 0 0 0 16 53 1 0 0 0 0 16 54 1 0 0 0 0 16 68 1 0 0 0 0 17 18 1 0 0 0 0 17 55 1 0 0 0 0 17 56 1 0 0 0 0 18 19 1 0 0 0 0 18 57 1 0 0 0 0 18 58 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 21 59 1 0 0 0 0 21 60 1 0 0 0 0 21 68 1 0 0 0 0 22 23 2 0 0 0 0 22 32 1 0 0 0 0 23 24 1 0 0 0 0 23 61 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 62 1 0 0 0 0 26 27 1 0 0 0 0 26 34 1 0 0 0 0 27 28 2 0 0 0 0 27 63 1 0 0 0 0 28 29 1 0 0 0 0 28 64 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 32 33 2 0 0 0 0 34 65 1 0 0 0 0 34 66 1 0 0 0 0 34 67 1 0 0 0 0 68 69 1 0 0 0 0 M CHG 1 68 1 M END