CHEMBRIDGE-ZINC00211061 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4480 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 -0.6130 1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 0.0510 1.9130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 -2.0900 1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -2.8510 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1430 -4.2270 0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 -4.8600 1.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3740 -4.1000 2.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3250 -2.7160 2.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0020 -4.7630 3.2530 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 -4.2520 3.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0430 -6.1060 3.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8320 -6.8680 4.6020 S 0 0 0 0 0 0 0 0 0 0 0 0 1.4930 -6.8760 2.3350 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8590 -6.3320 1.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3640 -7.0360 0.4150 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5830 -8.3340 2.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 -8.8600 3.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4650 -10.3600 3.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1110 -10.9310 4.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -12.3060 4.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 -13.1110 3.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 -12.5410 2.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -11.1650 2.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8250 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 -2.3580 -0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3120 -4.8120 -0.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7810 -2.1270 2.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5990 -8.7750 1.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4970 -8.6010 2.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 -8.4190 4.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 -8.5930 2.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 -10.3020 5.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7020 -12.7520 5.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7010 -14.1860 3.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 -13.1700 1.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6110 -10.7190 1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 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 10 2 0 0 0 0 6 7 2 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 2 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 19 35 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 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 24 2 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 25 40 1 0 0 0 0 M END