NIH-ZINC04104226 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 64 0 0 1 0 0 0 0 0999 V2000 0.0970 -1.7690 1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 -1.3140 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6280 -0.0040 0.3870 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8730 0.7800 0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5680 0.4050 -0.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7450 1.2700 2.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5340 -1.0710 1.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0970 -1.3400 3.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2730 -0.6970 3.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8040 -0.9410 4.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1800 -1.8420 5.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0070 -2.5220 5.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4680 -2.2380 4.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3600 -3.5320 6.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8280 -2.8280 7.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2330 -3.8120 8.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1800 -4.9020 8.8700 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7340 -5.6160 7.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3440 -4.6470 6.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9300 -4.9880 10.3920 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.5570 -6.2860 10.5410 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0170 -4.4900 11.4010 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2350 -3.7920 10.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4840 -4.1970 9.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5060 -3.2570 9.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2740 -1.9370 9.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0420 -1.5370 10.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0130 -2.4710 10.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2550 -1.0340 9.8680 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.2360 -4.1480 5.6280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -2.6090 0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -0.9630 1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 -2.1120 2.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 -1.1620 -0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6000 -2.1240 -0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3160 -0.3660 -0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0910 1.3410 -0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9990 0.5640 -1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6050 1.6480 1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8830 1.9340 2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9790 1.1680 3.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1860 -2.0180 1.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3140 -0.6780 1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7890 -0.0020 2.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7140 -0.4360 5.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6310 -2.0050 6.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5510 -2.7330 3.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0490 -2.1050 7.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6280 -2.2600 8.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 -4.2640 8.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9350 -3.2690 9.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9260 -6.1960 7.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4920 -6.3430 8.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2550 -4.2190 7.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6550 -5.2230 5.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6680 -5.2310 9.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4820 -3.5460 9.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8940 -0.5060 10.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0550 -2.1630 11.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5780 -4.7760 4.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3700 -0.0920 1.7240 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6870 -0.4480 2.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 61 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 6 61 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 7 61 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 44 1 0 0 0 0 10 11 1 0 0 0 0 10 45 1 0 0 0 0 11 12 2 0 0 0 0 11 46 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 17 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 52 1 0 0 0 0 18 53 1 0 0 0 0 19 54 1 0 0 0 0 19 55 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 56 1 0 0 0 0 25 26 1 0 0 0 0 25 57 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 58 1 0 0 0 0 28 59 1 0 0 0 0 30 60 1 0 0 0 0 61 62 1 0 0 0 0 M CHG 1 61 1 M END