NCID-ZINC01865659 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.5300 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.9170 -1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -4.9300 1.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3830 -5.0020 -0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0530 -4.8540 -1.2640 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3380 -4.8400 -2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9300 -3.5780 -1.2740 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1480 -3.2570 -0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2230 -4.0140 -1.9900 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.0710 -3.9260 -1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0520 -5.3860 -2.3830 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1050 -5.9740 -1.4640 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5900 -6.2180 -0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4860 -7.1640 -2.0510 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1990 -8.3160 -1.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6160 -9.2150 -2.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5730 -8.5170 -3.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1210 -7.2840 -3.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3360 -5.9470 -4.6740 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.0490 -9.0440 -4.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 -9.6410 -5.5930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 -8.8640 -5.1510 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2280 -10.4790 -1.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4280 -10.7750 -0.5290 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9790 -9.9000 0.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3580 -8.7020 -0.0980 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 -11.3990 -2.6690 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4540 -3.1410 -3.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7110 -3.4740 -3.8160 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2820 -2.5310 -2.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8360 -8.3880 -4.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -9.2120 -5.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1240 -10.1790 1.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 -11.1700 -3.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3850 -12.2710 -2.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4570 -2.0910 -2.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6560 -3.3140 -3.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9240 -2.9580 -4.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7880 -1.7080 -2.0380 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 7 2 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 42 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 7 44 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 37 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 35 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 33 2 0 0 0 0 23 24 1 0 0 0 0 23 30 2 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 45 1 0 0 0 0 29 46 1 0 0 0 0 30 31 1 0 0 0 0 30 34 1 0 0 0 0 31 32 2 0 0 0 0 32 33 1 0 0 0 0 32 47 1 0 0 0 0 34 48 1 0 0 0 0 34 49 1 0 0 0 0 35 36 1 0 0 0 0 35 50 1 0 0 0 0 35 51 1 0 0 0 0 36 52 1 0 0 0 0 37 53 1 0 0 0 0 M END