CHEMBRIDGE-ZINC02824137 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 1 0 0 0 0 0999 V2000 -0.0360 1.4300 -0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -0.0860 -0.0810 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4070 -0.5250 -0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -0.5320 1.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 -2.4670 1.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5510 -1.9270 0.0440 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0870 -2.3630 -0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4280 -0.5000 -0.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0350 -2.2640 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 -2.5330 2.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5880 -4.0330 2.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4290 -4.5280 3.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5830 -5.9360 3.4750 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2830 -6.6250 4.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8810 -6.0640 5.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5640 -6.8760 6.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6570 -8.2560 6.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0700 -8.8380 5.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3980 -8.0100 4.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7950 -8.6220 3.0900 N 0 3 0 0 0 0 0 0 0 0 0 0 1.7100 -9.1950 3.2590 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4110 -8.5320 2.0190 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9880 1.8100 -0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 1.7410 -1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 1.9050 0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7530 -0.2770 1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2460 -0.1040 2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3290 -2.0520 2.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9160 -3.5590 1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5460 -1.8050 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5130 -1.8680 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1980 -3.3460 0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7670 -2.2510 3.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3040 -2.0020 2.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6420 -4.5870 2.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0920 -4.2910 1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4100 -4.0370 3.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9100 -4.3120 4.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8380 -4.9990 5.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0260 -6.4270 7.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1880 -8.8740 6.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1400 -9.9110 4.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 -2.0480 1.3270 N 0 3 0 0 0 0 0 0 0 0 0 0 1.0440 -2.4600 0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 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 26 1 0 0 0 0 4 27 1 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 43 44 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M CHG 1 43 1 M END