NCID-ZINC04769349 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 0 0 0 0 0 0999 V2000 -0.7390 0.0360 0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 0.3270 -0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0170 -2.0290 -1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0750 -2.3570 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 -0.2430 -2.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4020 1.1460 -3.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8290 1.2660 -3.3340 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 2.4920 -3.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 3.4440 -3.9900 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7080 2.5430 -3.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3110 3.7910 -4.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7020 3.8920 -4.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5040 2.7480 -4.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8970 1.5040 -3.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5060 1.3980 -3.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9030 2.8470 -4.1680 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2720 2.8230 -5.3640 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6800 2.9110 -5.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2840 4.1680 -5.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6630 4.3010 -5.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4530 3.1780 -5.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8880 1.8960 -5.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4750 1.7650 -5.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9000 0.4880 -5.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6790 -0.6340 -6.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0560 -0.5050 -6.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6540 0.7430 -6.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8040 3.4100 -5.6070 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5460 0.2140 -0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8150 -0.9930 0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 0.6950 1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 1.3720 -0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4190 0.1650 0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2890 -2.5070 -2.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -2.3760 -0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0390 -1.9050 -0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7850 -2.0180 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 -3.4420 -0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 -0.3780 -2.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3830 -0.9890 -3.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 1.2570 -4.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 1.9270 -2.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7080 4.6950 -4.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1620 4.8660 -4.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5150 0.6120 -3.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0720 0.4120 -3.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6650 5.0430 -5.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1270 5.2750 -5.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8210 0.3580 -5.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2100 -1.6030 -6.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6690 -1.3730 -6.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7330 0.7970 -6.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2620 2.5980 -5.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9430 -0.5370 -1.3960 N 0 3 0 0 0 0 0 0 0 0 0 0 1.8920 -0.2540 -1.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 54 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 54 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 5 54 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 20 21 2 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 28 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 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 27 52 1 0 0 0 0 28 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END