CHEMDIV-ZINC00651747 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 0 0 0 0 0 0 0 0 0 0 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -1.8240 1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4610 -2.3500 2.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5740 -3.7170 2.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 -4.5700 1.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 -4.0380 0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 -2.6710 0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 -6.0390 1.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2970 -6.6650 2.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0500 -8.3980 2.1410 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3790 -8.2620 1.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -6.9530 1.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 -6.5220 1.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7520 -6.4400 0.2450 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1780 -6.2150 2.4150 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5250 -5.7940 2.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3050 -5.4910 3.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 -9.3330 1.7890 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 -10.5870 1.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 -10.7770 2.2060 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9990 -11.7520 1.9290 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7680 -11.6280 2.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6550 -11.8080 0.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 -11.9820 -0.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 -13.2810 -0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -13.2250 1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 -13.0510 2.1840 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9240 -13.8940 2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4130 -12.9960 3.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2750 -12.0170 4.2390 O 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 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8870 -1.6890 3.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 -4.1250 3.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 -4.6960 -0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 -2.2580 -0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2500 -6.1710 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4800 -4.8980 1.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0260 -6.5910 1.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3500 -6.3870 3.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8040 -4.6940 3.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3160 -5.1750 3.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 -9.1810 1.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3450 -12.6500 0.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2010 -10.8820 0.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 -12.0220 -1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 -11.1390 -0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 -14.1240 -0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 -13.4050 -1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 -14.1510 1.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5370 -12.3820 1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 -14.0340 3.9840 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5360 -13.9520 4.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 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 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 29 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 26 52 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 29 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 32 2 0 0 0 0 31 57 1 0 0 0 0 57 58 1 0 0 0 0 M END