IBS-ZINC04981533 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 63 0 0 1 0 0 0 0 0999 V2000 -0.8420 -2.9000 1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1750 -2.7150 0.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4320 -0.9230 -0.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5940 -0.7610 -2.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1380 -0.7410 1.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8600 0.7490 1.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4630 1.2800 3.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1700 2.6890 3.3980 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1370 3.7580 3.1840 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9550 3.5770 3.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3340 4.9490 3.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0910 4.6320 3.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9580 3.1640 3.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9400 2.5500 4.1230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 5.4410 4.4300 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8400 6.3240 3.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1970 7.2390 3.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2060 6.5730 4.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6630 6.0010 5.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9670 6.2520 5.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8090 7.0760 4.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3460 7.6640 3.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0390 7.4140 3.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0620 8.4890 2.9130 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.3910 8.8010 3.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6610 3.8290 1.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0320 3.7140 1.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5020 3.7770 0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5800 3.9450 -0.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2500 4.0540 -0.6130 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8250 4.0120 0.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 -3.9600 1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -2.3530 0.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8720 -2.5600 2.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0980 -3.0890 -0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9910 -3.2400 0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9620 0.0110 -0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1660 -1.7300 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8600 0.0440 -1.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0550 -1.6770 -2.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2380 -0.5050 -2.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6730 -1.2980 2.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2090 -0.9720 1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7770 0.9240 1.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2640 1.3080 1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5490 1.1360 3.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0330 0.7290 4.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3320 4.8660 4.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0190 5.3760 5.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3300 5.8150 6.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8160 7.2460 5.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6770 7.8770 2.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0150 7.9020 3.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4030 9.3250 4.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8160 9.4750 2.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7450 3.5840 2.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5620 3.7000 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8960 4.0000 -1.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7500 4.1220 0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5360 -1.2380 0.4160 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6580 -0.7190 0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 60 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 60 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 5 60 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 46 1 0 0 0 0 7 47 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 26 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 2 0 0 0 0 15 48 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 21 22 2 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 56 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 29 30 2 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 31 59 1 0 0 0 0 60 61 1 0 0 0 0 M CHG 1 60 1 M END