CHEMDIV-ZINC06876808 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -0.6750 1.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 -0.0670 1.9120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -2.1820 0.9950 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1350 -2.5340 0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3640 -2.6900 2.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 -4.2190 2.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -4.7730 2.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7740 -4.1770 1.1320 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8120 -2.7130 1.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4420 -4.9790 0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 -6.2730 0.2110 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2170 -6.9140 -0.7880 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5390 -8.2020 -1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3160 -8.1030 -2.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4720 -6.7950 -2.5750 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8200 -6.0870 -1.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4100 -4.4450 -1.1650 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.8920 -9.2360 -3.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6770 -8.9910 -4.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2110 -10.0460 -4.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9680 -11.3510 -4.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1870 -11.5980 -3.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6450 -10.5470 -2.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4960 -12.3890 -5.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2060 -13.7060 -4.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 -0.4910 -0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 -2.2930 2.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8390 -2.3580 3.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9160 -4.5520 1.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9600 -4.5790 3.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -5.8570 2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 -4.5170 3.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3510 -2.2890 1.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3120 -2.4370 0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2280 -9.1160 -0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8670 -7.9760 -4.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8190 -9.8570 -5.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9990 -12.6150 -3.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0340 -10.7400 -1.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6870 -14.4390 -5.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1280 -13.8660 -4.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5820 -13.8170 -3.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 11 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 M END