IFLAB-ZINC02698971 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 62 0 0 0 0 0 0 0 0999 V2000 0.6540 1.1610 -0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4510 -0.3150 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 -1.0430 0.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 -2.4210 0.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 -3.0740 0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 -2.3690 -0.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 -0.9900 -0.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 -4.8180 0.4580 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 -5.4250 -0.6500 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 -5.1370 1.8220 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7980 -5.2280 0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1500 -5.9460 -0.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3900 -5.9760 -0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6850 -6.3690 -0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7760 -6.0900 0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5580 -5.3970 1.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2560 -4.9990 1.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1460 -5.2630 0.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7990 -4.8620 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5270 -4.1500 2.3570 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1570 -4.8960 3.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1870 -4.1140 4.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8270 -1.9730 3.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8020 -2.7130 2.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 -1.9400 5.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6650 -5.1610 2.1910 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4860 -4.4360 3.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0740 -6.4510 -0.0510 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3280 -7.1660 -1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3640 1.3420 -1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 1.6580 -0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 1.6190 0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0830 -0.5390 1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7900 -2.9720 1.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 -2.8650 -1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1700 -0.4430 -1.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4210 -6.2660 -1.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8150 -6.9100 -1.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0760 -4.4800 2.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0720 -5.1060 4.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7140 -5.8690 3.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1070 -4.5910 5.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1890 -4.0260 4.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 -1.9160 2.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1900 -0.9620 3.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7630 -2.2540 1.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8210 -2.5630 2.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 -1.8540 5.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8230 -2.4910 6.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2830 -0.9540 5.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4660 -4.3270 3.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8410 -4.9820 4.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0980 -3.4310 3.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0650 -6.5660 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8070 -8.1280 -1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4030 -7.3690 -1.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4140 -6.3050 -1.1450 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6960 -2.6970 4.6830 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.6350 -2.7650 5.0970 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 19 2 0 0 0 0 12 37 1 0 0 0 0 12 57 2 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 13 57 1 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 16 17 2 0 0 0 0 16 26 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 58 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 58 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 25 58 1 0 0 0 0 26 27 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END