IBS-ZINC04046518 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 65 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 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0270 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4550 -2.5210 -2.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4760 -4.0510 -2.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 -4.5370 -3.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5040 -4.8420 -3.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1480 -5.3110 -4.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5070 -5.6430 -4.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0820 -6.0770 -6.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3240 -6.1920 -7.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9780 -5.8680 -7.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3770 -5.4250 -6.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0660 -5.1050 -6.1050 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4690 -4.6800 -4.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 -4.4080 -5.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9110 -6.6250 -8.4450 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3030 -6.9420 -8.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7760 -7.4020 -9.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9980 -7.4520 -10.6650 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0640 -7.7560 -9.9160 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5240 -8.2030 -11.2330 C 0 0 3 0 0 0 0 0 0 0 0 0 8.9950 -7.6490 -12.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0270 -7.9500 -11.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2960 -6.4440 -11.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8000 -6.1920 -11.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0680 -4.6860 -11.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2470 -9.6760 -11.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7190 -10.2900 -10.4930 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2880 -4.7030 -2.4480 C 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 0.5290 -0.3650 0.8850 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 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -2.3880 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -2.4050 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 -2.1600 -3.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 -2.1440 -2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 -4.4120 -1.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 -4.4280 -2.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1000 -5.5550 -4.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1310 -6.3330 -6.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3970 -5.9590 -8.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8640 -6.0580 -8.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4610 -7.7380 -7.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6860 -7.7160 -9.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5480 -8.4310 -10.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3860 -8.3620 -12.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7750 -5.9630 -12.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9370 -6.0320 -10.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3200 -6.6720 -10.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1580 -6.6040 -12.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5480 -4.2050 -12.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7100 -4.2740 -10.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1400 -4.5060 -11.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2440 -5.6390 -1.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3260 -4.4680 -2.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8600 -3.9020 -1.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5860 -10.3060 -12.5250 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3880 -11.2510 -12.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 6 44 1 0 0 0 0 7 8 2 0 0 0 0 7 16 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 46 1 0 0 0 0 12 13 2 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 50 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 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 29 30 2 0 0 0 0 29 63 1 0 0 0 0 31 60 1 0 0 0 0 31 61 1 0 0 0 0 31 62 1 0 0 0 0 63 64 1 0 0 0 0 M END