NCID-ZINC05217636 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 57 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7780 -2.5480 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7160 -4.0760 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1300 -4.6440 0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4040 -6.6890 0.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2910 -8.2110 0.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6900 -8.8160 0.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5770 -10.3380 0.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9750 -10.9440 0.8910 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.5980 -10.6150 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8750 -12.4470 0.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9130 -13.0630 1.9180 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1080 -4.5470 -1.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7600 -3.7420 -2.1210 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 2.0550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 3.5850 0.0080 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8100 3.9360 0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8060 4.1060 0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3880 4.4920 -0.8650 O 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 0.5120 -0.3560 -0.8950 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 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3140 -2.2000 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2970 -2.2100 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1040 -4.4200 0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6020 -4.2340 1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7160 -4.3740 -0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9990 -6.4330 -0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8850 -6.2920 1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8100 -8.6070 -0.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6960 -8.4670 1.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1710 -8.4200 1.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2840 -8.5610 -0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0960 -10.7350 -0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9820 -10.5940 1.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0180 -10.7960 2.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9440 1.6940 0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 1.7040 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 5.0790 -1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0020 0.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 -2.3530 -0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0610 -6.1080 0.2540 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5700 -6.5080 -0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7430 -13.1020 -0.2850 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5770 -10.5030 2.1560 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.7150 -9.5030 2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9540 -5.8600 -1.5210 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4140 4.1410 1.3170 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7920 4.0740 -1.2390 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 3.7620 -2.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3180 4.4840 1.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5590 -6.1140 -2.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6820 -14.0660 -0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 45 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 4 45 1 0 0 0 0 5 6 1 0 0 0 0 5 15 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 6 47 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 7 47 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 50 1 0 0 0 0 13 14 2 0 0 0 0 13 49 1 0 0 0 0 15 16 2 0 0 0 0 15 52 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 54 1 0 0 0 0 20 21 2 0 0 0 0 20 53 1 0 0 0 0 41 50 1 0 0 0 0 44 54 1 0 0 0 0 45 46 1 0 0 0 0 47 48 1 0 0 0 0 49 58 1 0 0 0 0 50 51 1 0 0 0 0 52 57 1 0 0 0 0 53 56 1 0 0 0 0 54 55 1 0 0 0 0 M END