CHEMDIV-ZINC04793872 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 73 0 0 1 0 0 0 0 0999 V2000 0.5360 1.2780 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 -0.1660 0.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -0.8860 1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 -2.2340 0.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5860 -2.3150 -0.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 -1.0110 -1.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 -0.7400 -2.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5130 -1.8200 -3.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3150 -3.1280 -2.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 -3.3890 -1.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 -3.4130 1.6620 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3790 -4.2540 1.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7330 -3.8360 1.4560 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9760 -3.7080 0.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6830 -2.9830 2.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0050 -2.7960 1.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8850 -2.0050 2.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4580 -1.4040 3.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1500 -1.5920 4.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2620 -2.3780 3.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8800 -2.5750 3.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 -2.2820 5.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -3.1240 3.0710 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4150 -3.3680 3.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9390 -5.3220 1.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5380 -6.0500 0.9490 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4500 -5.7920 2.9420 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5730 -7.1900 3.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0190 -7.5940 3.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7940 -10.0380 3.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4760 -9.2920 4.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5460 -10.5650 5.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9110 -10.6570 6.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9640 -11.8430 7.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6510 -12.9470 7.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2870 -12.8660 5.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2370 -11.6820 5.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 1.5640 -0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 1.6310 -0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2170 1.6950 0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -0.3870 2.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4120 0.2780 -2.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8710 -1.6350 -4.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5200 -3.9550 -3.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 -4.4170 -1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3550 -3.2580 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9030 -1.8530 2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1430 -0.7850 4.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8270 -1.1150 5.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1000 -2.7550 2.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5480 -3.1230 4.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6490 -4.4260 3.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 -5.1570 3.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 -7.7820 2.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -7.3480 4.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4010 -6.9490 4.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6860 -7.5060 2.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7760 -9.8620 2.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5160 -9.9250 2.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8420 -11.0400 3.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2170 -9.2760 3.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6920 -8.4480 5.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3790 -9.8060 7.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4730 -11.9060 8.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6930 -13.8690 7.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8250 -13.7260 5.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7460 -11.6440 4.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1150 -9.0300 4.1400 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.4220 -9.1530 4.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 41 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 8 9 2 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 44 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 23 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 25 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 18 19 2 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 20 21 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 24 50 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 29 68 1 0 0 0 0 30 58 1 0 0 0 0 30 59 1 0 0 0 0 30 60 1 0 0 0 0 30 68 1 0 0 0 0 31 32 1 0 0 0 0 31 61 1 0 0 0 0 31 62 1 0 0 0 0 31 68 1 0 0 0 0 32 33 1 0 0 0 0 32 37 2 0 0 0 0 33 34 2 0 0 0 0 33 63 1 0 0 0 0 34 35 1 0 0 0 0 34 64 1 0 0 0 0 35 36 2 0 0 0 0 35 65 1 0 0 0 0 36 37 1 0 0 0 0 36 66 1 0 0 0 0 37 67 1 0 0 0 0 68 69 1 0 0 0 0 M CHG 1 68 1 M END