IBS-ZINC00629490 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 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 0.0230 -0.7020 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0910 1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7480 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -3.9650 -0.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0130 -1.2160 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6700 -1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.0400 -2.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6890 -2.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -2.5100 2.4810 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -1.4010 3.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -0.3370 2.4830 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -1.3840 5.1380 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -3.8970 2.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5320 -4.3600 3.1050 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0610 -4.2140 2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5570 -5.8440 3.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9090 -6.3060 3.5050 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1090 -7.6120 3.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0090 -8.4300 4.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1770 -9.7410 4.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4720 -10.2860 4.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6810 -11.6360 4.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9480 -12.1310 4.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0460 -11.3180 4.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8820 -10.0060 4.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5880 -9.4590 4.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3800 -8.1100 3.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1720 -3.6000 4.1320 O 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 -1.0120 -2.8710 -2.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 -2.0610 -3.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -3.6400 -2.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4210 -3.9600 3.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4300 -4.5350 2.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 -5.9780 4.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 -6.4140 2.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 -8.0140 4.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 -10.3610 4.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8410 -12.2780 5.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1060 -13.1700 5.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0410 -11.7360 4.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7410 -9.3880 4.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2210 -7.4700 3.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7540 -3.6830 5.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 3 4 2 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 30 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 29 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 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 29 47 1 0 0 0 0 30 48 1 0 0 0 0 M END