CHEMBRIDGE-ZINC04754951 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 1.2410 0.2320 -1.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 -0.9270 -0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 -1.1730 -0.3370 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1620 -2.1660 0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4770 -2.8090 1.1420 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6300 -2.4790 0.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0600 -1.8600 -0.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8050 -3.9590 -0.1190 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8430 -4.1510 -0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4330 -4.7890 1.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2790 -7.0710 -0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3310 -4.2990 2.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9820 -5.3120 3.1560 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8660 -6.4700 2.3730 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1380 -6.1540 1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1340 -7.0050 0.0670 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5790 -2.8580 2.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3420 -2.1880 1.5660 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.7680 -2.7400 1.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3860 -0.7760 1.7830 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9040 -4.3090 -1.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 -4.5760 -1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2600 -4.8970 -2.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2530 -4.9520 -3.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5910 -4.6860 -3.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 -4.3690 -2.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1390 -4.7440 -4.9930 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.4120 -5.0260 -5.9280 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3180 -4.5090 -5.1880 O 0 5 0 0 0 0 0 0 0 0 0 0 2.3060 0.4170 -0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 -0.0220 -2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 1.1280 -0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3640 -1.8240 -0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9940 -0.6740 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8360 -5.2530 4.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1740 -2.8100 3.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6280 -2.3490 2.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7340 -3.8170 1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2750 -2.5330 2.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3100 -2.2640 0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8250 -0.5180 2.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 -4.5330 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3050 -5.1050 -1.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 -5.2020 -4.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4640 -4.1650 -2.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 18 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 21 1 0 0 0 0 10 12 2 0 0 0 0 10 15 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 45 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END