CHEMBRIDGE-ZINC00461574 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 1 0 0 0 0 0999 V2000 -0.0210 1.5250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 -0.0040 0.0060 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0020 -0.3910 0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8700 -0.5030 1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 -2.0240 1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7130 -2.3960 -0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 -1.9180 -1.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5970 -0.4810 -1.2550 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 0.3830 -2.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 1.5790 -2.0720 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3680 -0.1180 -3.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7630 0.7480 -4.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 0.2450 -5.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6570 1.1400 -6.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1080 0.6610 -7.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1550 -0.7020 -8.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7500 -1.5940 -7.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3020 -1.1310 -6.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6400 -1.2080 -9.5310 N 0 3 0 0 0 0 0 0 0 0 0 0 3.9960 -0.4260 -10.3930 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6820 -2.4070 -9.7410 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9870 1.9100 -0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 1.8770 -0.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3980 1.8780 0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8560 -0.0420 1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 -0.2380 2.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6030 -2.3850 1.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -2.4840 1.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6920 -1.9160 -0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 -3.4770 -0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4040 -2.0910 -2.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 -2.4630 -1.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4060 -1.1810 -3.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7260 1.8120 -4.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6210 2.2040 -6.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4260 1.3510 -8.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7890 -2.6570 -7.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9910 -1.8280 -5.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END