IBS-ZINC04090650 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 1 0 0 0 0 0999 V2000 -0.3180 2.2050 0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 0.7390 0.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6110 0.6560 -0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 0.3660 1.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1570 -0.1860 0.3020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7670 -0.0180 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9550 0.0070 -1.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5300 -0.4990 -2.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1280 0.7290 -0.9580 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8410 1.1850 0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2670 1.3780 -0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0810 1.8730 -1.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8410 1.1200 -2.1920 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1140 0.1990 -2.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1140 2.0900 -3.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1260 2.7240 -2.6890 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7840 -1.6050 0.2580 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7620 -2.4280 1.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 -1.9680 2.4900 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 -3.7860 1.0850 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7010 -4.3070 -0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 -5.7970 -0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2510 -6.2900 -1.5260 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 -6.5930 0.5980 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -6.1020 1.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 -4.7210 2.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3520 -4.3170 3.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -5.2510 4.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 -6.6120 4.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 -7.0390 2.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5650 2.8530 0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9550 2.5530 -0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 2.3500 1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 0.3870 2.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5050 -0.6310 1.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9250 1.0680 1.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7910 0.4580 1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3950 2.1300 0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7940 0.4160 -0.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8350 2.0740 0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9610 1.6720 -2.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9240 2.9590 -1.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 -1.9420 -0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5760 -3.8210 -0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 -4.0240 -0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 -7.5900 0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4450 -3.2680 3.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0910 -4.9060 5.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 -7.3360 4.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 -8.1050 2.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6330 2.1670 -4.3160 O 0 5 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 4 1 0 0 0 0 2 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 17 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 51 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 26 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 29 2 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 M CHG 1 51 -1 M END